SCHEMBL174889

SCHEMBL174889

Nc1nc(-c2nn(Cc3ccccc3F)c3ncc(F)cc23)nc(N)c1/N=N/c1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PDE5A O76074 17/20 0.55
GUCY1A1 Q02108 2/20 0.54
GUCY1B1 Q02153 2/20 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
SCHEMBL29859571 1.00 PDE5A (0.55) PDE5AGUCY1A1GUCY1B1
SCHEMBL428374 1.00 PDE5A (0.55) PDE5AGUCY1A1GUCY1B1
SCHEMBL25831021 0.94 PDE5A (0.53) PDE5AGUCY1A1GUCY1B1
SCHEMBL18672354 0.89 PDE5A (0.45) PDE5AGUCY1A1GUCY1B1
SCHEMBL24114778 0.88 PDE5A (0.57) PDE5AGUCY1A1GUCY1B1
SCHEMBL26637716 0.88 PDE5A (0.59) PDE5AGUCY1A1GUCY1B1
SCHEMBL30223310 0.87 GUCY1A1 (0.48) PDE5AGUCY1A1GUCY1B1
SCHEMBL24114687 0.87 GUCY1A1 (0.48) PDE5AGUCY1A1GUCY1B1
SCHEMBL1931369 0.87 ADORA3 (0.59) PDE5AGUCY1A1GUCY1B1
SCHEMBL1931373 0.87 ADORA3 (0.59) PDE5AGUCY1A1GUCY1B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12637456-B2 Process for preparing methyl {4,6-diamino-2-[5-fluoro-1-(2-fluorobenzyl)-1H-pyrazolo[3,4-b]pyridin-3-yl]pyrimidin-5-yl} carbamate ADVERIO PHARMA GMBH (DE) 2026-05-26 US disclosed
CN-119954802-A Process for preparing compounds 阿德弗里奥药品有限责任公司 2025-05-09 CN disclosed
CN-119954803-A Process for preparing compounds 阿德弗里奥药品有限责任公司 2025-05-09 CN disclosed
CN-115697978-B Process for preparing methyl {4, 6-diamino-2- [ 5-fluoro-1- (2-fluorobenzyl) -1H-pyrazolo [3,4-b ] pyridin-3-yl ] pyrimidin-5-yl } carbamate 阿德弗里奥药品有限责任公司 2025-02-28 CN disclosed
US-12064429-B2 Substituted 5-fluoro-1H-pyrazolopyridines and their use ADVERIO PHARMA GMBH (DE) 2024-08-20 US disclosed
CN-117946096-A Vitamin Li Xigu intermediate and preparation method thereof 上海医药工业研究院有限公司 2024-04-30 CN disclosed
CN-117946097-A Vitamin Li Xigu, intermediate thereof and preparation method 上海医药工业研究院有限公司 2024-04-30 CN disclosed
US-20230257398-A1 PYRIMIDINE-BASED TRICYCLIC COMPOUND AND USE THEREOF CHIA TAL TIANQING PHARMACEUTICAL GROUP CO., LTD. (CN) 2023-08-17 US disclosed
US-20230257398-A1 PYRIMIDINE-BASED TRICYCLIC COMPOUND AND USE THEREOF CHIA TAL TIANQING PHARMACEUTICAL GROUP CO., LTD. (CN) 2023-08-17 US disclosed
US-20230219952-A1 PROCESS FOR PREPARING METHYL {4,6-DIAMINO-2-[5-FLUORO-1-(2-FLUOROBENZYL)-1H-PYRAZOLO[3,4-B]PYRIDIN-3 -YL]PYRIMIDIN-5-YL} CARBAMATE ADVERIO PHARMA GMBH (DE) 2023-07-13 US disclosed
US-8420656-B2 Substituted 5-fluoro-1H-pyrazolopyridines and their use BAYER INTELLECTUAL PROPERTY GMBH (DE) 2013-04-16 US disclosed
US-8420656-B2 Substituted 5-fluoro-1H-pyrazolopyridines and their use BAYER INTELLECTUAL PROPERTY GMBH (DE) 2013-04-16 US disclosed
WO-2012028647-A1 BICYCLIC AZA HETEROCYCLES, AND USE THEREOF BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2012-03-08 WO disclosed
WO-2012028647-A1 BICYCLIC AZA HETEROCYCLES, AND USE THEREOF BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2012-03-08 WO disclosed
US-20120022084-A1 Substituted 5-fluoro-1H-pyrazolopyridines and their use BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2012-01-26 US disclosed
US-20120022084-A1 Substituted 5-fluoro-1H-pyrazolopyridines and their use BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2012-01-26 US disclosed
US-20120022084-A1 Substituted 5-fluoro-1H-pyrazolopyridines and their use BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2012-01-26 US disclosed
WO-2011161099-A1 USE OF STIMULATORS AND ACTIVATORS OF SOLUBLE GUANYLATE CYCLASE FOR TREATING SICKLE-CELL ANEMIA AND CONSERVING BLOOD SUBSTITUTES BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2011-12-29 WO disclosed
WO-2011147809-A1 SUBSTITUTED 5-FLUORO-1H-PYRAZOLOPYRIDINES AND USE THEREOF BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2011-12-01 WO disclosed
WO-2011147810-A1 THE USE OF sGC STIMULATORS, sGC ACTIVATORS, ALONE AND COMBINATIONS WITH PDE5 INHIBITORS FOR THE TREATMENT OF SYSTEMIC SCLEROSIS (SSc). BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2011-12-01 WO 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 (5 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-12064429-B2 Substituted 5-fluoro-1H-pyrazolopyridines and their use PFKP, PON1, FABP3 PDE5A 121/4885GUCY1A1 1337/4885GUCY1B1 1025/4885
US-20230257398-A1 PYRIMIDINE-BASED TRICYCLIC COMPOUND AND USE THEREOF TYMP, TYMS, DPYD PDE5A 1421/4885GUCY1A1 2940/4885GUCY1B1 2239/4885
US-12637456-B2 Process for preparing methyl {4,6-diamino-2-[5-fluoro-1-(2-fluorobenzyl)-1H-pyrazolo[3,4-b]pyridin-3-yl]pyrimidin-5-yl} carbamate POLL, F9, DNMT3B PDE5A 445/4885GUCY1A1 952/4885GUCY1B1 635/4885
US-20230219952-A1 PROCESS FOR PREPARING METHYL {4,6-DIAMINO-2-[5-FLUORO-1-(2-FLUOROBENZYL)-1H-PYRAZOLO[3,4-B]PYRIDIN-3 -YL]PYRIMIDIN-5-YL} CARBAMATE POLL, DNMT3B, MTAP PDE5A 429/4885GUCY1A1 1281/4885GUCY1B1 798/4885
US-20120022084-A1 Substituted 5-fluoro-1H-pyrazolopyridines and their use PFKP, PON1, FABP3 PDE5A 121/4885GUCY1A1 1337/4885GUCY1B1 1025/4885

“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.