SCHEMBL248358

SCHEMBL248358

COC(=O)Nc1c(N)nc(-c2nn(Cc3ccccc3F)c3ncccc23)nc1N

nearest known ligand 0.73

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ADORA3 P0DMS8 1/20 0.73
KCNH2 Q12809 1/20 0.73
GUCY1A1 Q02108 11/20 0.55
GUCY1B1 Q02153 11/20 0.55
PDE5A O76074 7/20 0.54

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL29379641 1.00 ADORA3 (0.73) ADORA3KCNH2GUCY1A1GUCY1B1PDE5A
Hydrochloric Acid SCHEMBL28612648 0.99 ADORA3 (0.72) ADORA3KCNH2GUCY1A1GUCY1B1PDE5A
SCHEMBL256216 0.95 ADORA3 (0.69) ADORA3KCNH2GUCY1A1GUCY1B1PDE5A
SCHEMBL5472954 0.92 ADORA3 (0.67) ADORA3KCNH2GUCY1A1GUCY1B1PDE5A
SCHEMBL12630446 0.92 ADORA3 (0.67) ADORA3KCNH2GUCY1A1GUCY1B1PDE5A
SCHEMBL31738661 0.91 ADORA3 (0.66) ADORA3KCNH2GUCY1A1GUCY1B1PDE5A
SCHEMBL5473383 0.91 ADORA3 (0.66) ADORA3KCNH2GUCY1A1GUCY1B1PDE5A
SCHEMBL18212217 0.91 ADORA3 (0.70) ADORA3KCNH2GUCY1A1GUCY1B1PDE5A
SCHEMBL5481770 0.90 ADORA3 (0.64) ADORA3KCNH2GUCY1A1GUCY1B1PDE5A
SCHEMBL2009564 0.90 ADORA3 (0.68) ADORA3KCNH2GUCY1A1GUCY1B1PDE5A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 234 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220211702-A1 METHODS AND MATERIALS FOR GENDER-DEPENDENT TREATMENT OF CARDIOVASCULAR DYSFUNCTION MAYO FOUNDATION FOR MEDICAL EDUCATION AND RESEARCH 2022-07-07 US claimed
EP-3952992-A1 METHODS AND MATERIALS FOR GENDER-DEPENDENT TREATMENT OF CARDIOVASCULAR DYSFUNCTION Mayo Foundation for Medical Education and Research (US) 2022-02-16 EP claimed
US-20190284186-A1 PROCESS FOR PREPARING METHYL{4,6-DIAMINO-2-[1-(2-FLUOROBENZYL)-1H-PYRAZOLO[3,4-B]PYRIDIN-3-YL]PYRIMIDIN-5-YL}METHYLCARBAMATE AND ITS PURIFICATION FOR USE AS PHARMACEUTICALLY ACTIVE COMPOUND ADVERIO PHARMA GMBH (DE) 2019-09-19 US claimed
US-10351562-B2 Process for preparing methyl {4,6-diamino-2-[1-(2-fluorobenzyl)-1H-pyrazolo[3,4-B]pyridin-3-yl]pyrimidin-5-yl}methylcarbamate and its purification for use as pharmaceutically active compound ADVERIO PHARMA GMBH (DE) 2019-07-16 US claimed
EP-3498298-A1 THE USE OF SGC STIMULATORS AND SGC ACTIVATORS ALONE OR IN COMBINATION WITH PDE5 INHIBITORS FOR THE TREATMENT OF BONE DISORDERS INCLUDING OSTEOGENESIS IMPERFECTA (OI) Bayer AG (DE) 2019-06-19 EP claimed
US-20180282329-A1 PROCESS FOR PREPARING METHYL {4,6-DIAMINO-2-[1-(2-FLUOROBENZYL)-1H-PYRAZOLO[3,4-B]PYRIDIN-3-YL]PYRIMIDIN-5-YL}METHYLCARBAMATE AND ITS PURIFICATION FOR USE AS PHARMACEUTICALLY ACTIVE COMPOUND ADVERIO PHARMA GMBH (DE) 2018-10-04 US claimed
EP-2733142-B1 Process for the preparation of methyl-{4,6-diamino-2-[1-(2-fluorobenzyl)-1H-pyrazolo[3,4-b]pyridin-3-yl]pyrimidin-5-yl}methylcarbamate for use as pharmaceutically active ingredient ADVERIO PHARMA GMBH (DE) 2018-08-01 EP claimed
WO-2018096550-A1 PROCESS FOR THE PREPARATION OF METHYL 4,6-DIAMINO-2-[1-(2-FLUOROBENZYL)-1H-PYRAZOLO[3,4-B]PYRIDIN-3-YL]-5-PYRIMIDINYL(METHYL)CARBAMATE AND ITS POLYMORPHS THEREOF MSN LABORATORIES PRIVATE LIMITED, R&D CENTER (IN) 2018-05-31 WO claimed
WO-2017025981-A1 PROCESS FOR THE PREPARATION OF METHYL 4,6-DIAMINO-2-[L-(2-FHIOROBENZVR)-LH-PYRAZOLO I3,4-BLPVRIDIN-3-VN-5-PYRIMIDINYL(METHVL)CARBAMATE AND ITS POLYMORPHS THEREOF MSN LABORATORIES PRIVATE LIMITED (IN) 2017-02-16 WO claimed
US-8853398-B2 Process for preparing methyl {4,6-diamino-2-[1-(2-fluorobenzyl)-1H-pyrazolo[3,4-b] pyridin-3-yl]pyrimidin-5-yl}methylcarbamate and its purification for use as pharmaceutically active compound BAYER INTELLECTUAL PROPERTY GMBH (DE) 2014-10-07 US claimed
US-20140288303-A1 PROCESS FOR PREPARING METHYL METHYLCARBAMATE AND ITS PURIFICATION FOR USE AS PHARMACEUTICALLY ACTIVE COMPOUND BAYER INTELLECTUAL PROPERTY GMBH (DE) 2014-09-25 US claimed
US-20130310563-A1 PROCESS FOR PREPARING METHYL METHYLCARBAMATE AND ITS PURIFICATION FOR USE AS PHARMACEUTICALLY ACTIVE COMPOUND BAYER INTELLECTUAL PROPERTY GMBH (DE) 2013-11-21 US claimed
US-20120003325-A1 USE OF HELIUM-OXYGEN GAS MIXTURES FOR TREATING PULMONARY ARTERIAL HYPERTENSION BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2012-01-05 US claimed
US-20110130410-A1 PROCESS FOR PREPARING METHYL METHYLCARBAMATE AND ITS PURIFICATION FOR USE AS PHARMACEUTICALLY ACTIVE COMPOUND BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2011-06-02 US claimed
US-20110130411-A1 PROCESS FOR PREPARING METHYL CARBAMATE AND ITS PURIFICATION FOR USE AS PHARMACEUTICALLY ACTIVE COMPOUND BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2011-06-02 US claimed
US-7173037-B2 Carbamate-substituted pyrazolopyridines BAYER HEALTHCARE AG (DE) 2007-02-06 US claimed
EP-1506193-B1 CARBAMATE-SUBSTITUTED PYRAZOLOPYRIDINES BAYER HEALTHCARE AG (DE) 2006-06-21 EP claimed
EP-1506193-B9 CARBAMATE-SUBSTITUTED PYRAZOLOPYRIDINES ADVERIO PHARMA GMBH (DE) 2026-02-18 EP disclosed
WO-2007009607-A1 NOVEL USE OF ACTIVATORS AND STIMULATORS OF SOLUBLE GUANYLATE CYCLASE FOR THE PREVENTION OR TREATMENT OF RENAL DISORDERS BAYER HEALTHCARE AG (DE) 2007-01-25 WO disclosed
US-20060052397-A1 Compounds for trearment of cardiovascular disorders and hypotensive agents BAYER HEALTHCARE AG (DE) 2006-03-09 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (9 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110130410-A1 PROCESS FOR PREPARING METHYL METHYLCARBAMATE AND ITS PURIFICATION FOR USE AS PHARMACEUTICALLY ACTIVE COMPOUND AMD1, TPMT, MMAB ADORA3 1317/4885KCNH2 748/4885GUCY1A1 1234/4885
US-20120003325-A1 USE OF HELIUM-OXYGEN GAS MIXTURES FOR TREATING PULMONARY ARTERIAL HYPERTENSION PTGIS, HYOU1, PTGIR ADORA3 385/4885KCNH2 165/4885GUCY1A1 505/4885
US-20180282329-A1 PROCESS FOR PREPARING METHYL {4,6-DIAMINO-2-[1-(2-FLUOROBENZYL)-1H-PYRAZOLO[3,4-B]PYRIDIN-3-YL]PYRIMIDIN-5-YL}METHYLCARBAMATE AND ITS PURIFICATION FOR USE AS PHARMACEUTICALLY ACTIVE COMPOUND TPMT, AMD1, DPYD ADORA3 1331/4885KCNH2 595/4885GUCY1A1 1723/4885
US-20110130411-A1 PROCESS FOR PREPARING METHYL CARBAMATE AND ITS PURIFICATION FOR USE AS PHARMACEUTICALLY ACTIVE COMPOUND AZI2, TPMT, KDM5B ADORA3 2401/4885KCNH2 694/4885GUCY1A1 328/4885
US-10351562-B2 Process for preparing methyl {4,6-diamino-2-[1-(2-fluorobenzyl)-1H-pyrazolo[3,4-B]pyridin-3-yl]pyrimidin-5-yl}methylcarbamate and its purification for use as pharmaceutically active compound TPMT, AMD1, DPYD ADORA3 1267/4885KCNH2 561/4885GUCY1A1 1683/4885
US-20190284186-A1 PROCESS FOR PREPARING METHYL{4,6-DIAMINO-2-[1-(2-FLUOROBENZYL)-1H-PYRAZOLO[3,4-B]PYRIDIN-3-YL]PYRIMIDIN-5-YL}METHYLCARBAMATE AND ITS PURIFICATION FOR USE AS PHARMACEUTICALLY ACTIVE COMPOUND TPMT, AMD1, DPYD ADORA3 1267/4885KCNH2 561/4885GUCY1A1 1683/4885
US-20130310563-A1 PROCESS FOR PREPARING METHYL METHYLCARBAMATE AND ITS PURIFICATION FOR USE AS PHARMACEUTICALLY ACTIVE COMPOUND AMD1, TPMT, MMAB ADORA3 1317/4885KCNH2 748/4885GUCY1A1 1234/4885
US-20140288303-A1 PROCESS FOR PREPARING METHYL METHYLCARBAMATE AND ITS PURIFICATION FOR USE AS PHARMACEUTICALLY ACTIVE COMPOUND AMD1, TPMT, MMAB ADORA3 1317/4885KCNH2 748/4885GUCY1A1 1234/4885
US-20060052397-A1 Compounds for trearment of cardiovascular disorders and hypotensive agents PDE3A, PDE3B, PDE2A ADORA3 221/4885KCNH2 917/4885GUCY1A1 7/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.