SCHEMBL160968

SCHEMBL160968

c1ncc2c(n1)CCNC2

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
HTR2C P28335 2/20 0.40
CHRNB2 P17787 1/20 0.38
CHRNA4 P43681 1/20 0.38
PNMT P11086 5/20 0.38
CD44 P16070 1/20 0.38
MAOB P27338 1/20 0.38
ATR Q13535 2/20 0.35
CYP3A4 P08684 1/20 0.35
ASIC3 Q9UHC3 2/20 0.34
PKN2 Q16513 1/20 0.33
ADRA2A P08913 1/20 0.32
ADRA2B P18089 1/20 0.32
ADRA2C P18825 1/20 0.32

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
SCHEMBL29772412 1.00 POLB (0.43) POLBSMN1; SMN2HTR2CCHRNB2CHRNA4
Hydrochloric Acid SCHEMBL31126075 0.98 POLB (0.42) POLBSMN1; SMN2HTR2CCHRNB2CHRNA4
Hydrochloric Acid SCHEMBL7009520 0.98 POLB (0.42) POLBSMN1; SMN2HTR2CCHRNB2CHRNA4
Bicarbonate SCHEMBL28884573 0.90 ATR (0.39) POLBSMN1; SMN2HTR2CCHRNB2CHRNA4
SCHEMBL2453582 0.89 POLB (0.35) POLBSMN1; SMN2HTR2CCHRNB2CHRNA4
SCHEMBL2342848 0.86 CHRNB2 (0.48) HTR2CCHRNB2CHRNA4
SCHEMBL397493 0.84 HTR2C (0.46) POLBSMN1; SMN2HTR2CCHRNB2CHRNA4
SCHEMBL29428686 0.84 HTR2C (0.46) POLBSMN1; SMN2HTR2CCHRNB2CHRNA4
Hydrochloric Acid SCHEMBL6438259 0.84 CHRNB2 (0.47) HTR2CCHRNB2CHRNA4
Hydrochloric Acid SCHEMBL6767466 0.82 HTR2C (0.45) POLBSMN1; SMN2HTR2CCHRNB2CHRNA4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11434247-B1 Substituted furanopyrimidine compounds as PDE1 inhibitors DART NEUROSCIENCE LLC (US) 2022-09-06 US claimed
EP-3717488-B1 SUBSTITUTED FURANOPYRIMIDINE COMPOUNDS AS PDE1 INHIBITORS DART NEUROSCIENCE LLC (US) 2021-09-29 EP claimed
EP-3717488-A1 SUBSTITUTED FURANOPYRIMIDINE COMPOUNDS AS PDE1 INHIBITORS Dart NeuroScience, LLC (US) 2020-10-07 EP claimed
US-10772874-B2 Compounds and compositions for the inhibition of NAMPT VALO HEALTH, INC. 2020-09-15 US claimed
CN-111655695-A Substituted furopyrimidines as PDE1 inhibitors 达特神经科学有限公司 2020-09-11 CN claimed
CN-105712974-B Certain amino-pyrimidines, compositions thereof and methods of use thereof 赛特凯恩蒂克公司 2020-07-31 CN claimed
US-10456382-B2 Compounds and compositions for the inhibition of NAMPT FORMA TM, LLC (US) 2019-10-29 US claimed
WO-2019104285-A1 SUBSTITUTED FURANOPYRIMIDINE COMPOUNDS AS PDE1 INHIBITORS DART NEUROSCIENCE, LLC (US) 2019-05-31 WO claimed
US-10272072-B2 Compounds and compositions for the inhibition of NAMPT FORMA TM, LLC (US) 2019-04-30 US claimed
US-20190105307-A1 NOVEL COMPOUNDS AND COMPOSITIONS FOR THE INHIBITION OF NAMPT Valo Health, LLC 2019-04-11 US claimed
US-20170368039-A1 NOVEL COMPOUNDS AND COMPOSITIONS FOR THE INHIBITION OF NAMPT FORMA TM, LLC (US) 2017-12-28 US claimed
US-20140294805-A1 NOVEL COMPOUNDS AND COMPOSITIONS FOR THE INHIBITION OF NAMPT VALO EARLY DISCOVERY, INC. 2014-10-02 US claimed
EP-2734521-A1 TETRAHYDROPYRIDO-PYRIDINE AND TETRAHYDROPYRIDO-PYRIMIDINE COMPOUNDS AND USE THEREOF AS C5A RECEPTOR MODULATORS Novartis AG (CH) 2014-05-28 EP claimed
EP-2611804-A1 NOVEL COMPOUNDS AND COMPOSITIONS FOR THE INHIBITION OF NAMPT Forma TM, LLC. (US) 2013-07-10 EP claimed
WO-2013016197-A1 TETRAHYDROPYRIDO-PYRIDINE AND TETRAHYDROPYRIDO-PYRIMIDINE COMPOUNDS AND USE THEREOF AS C5A RECEPTOR MODULATORS NOVARTIS AG (CH) 2013-01-31 WO claimed
WO-2012031197-A1 NOVEL COMPOUNDS AND COMPOSITIONS FOR THE INHIBITION OF NAMPT FORMA THERAPEUTICS, INC. (US) 2012-03-08 WO claimed
US-20110201628-A1 HETEROCYCLIC JAK KINASE INHIBITORS ASTRAZENECA AB (SE) 2011-08-18 US claimed
EP-4737470-A2 C10-ALKYLENE SUBSTITUTED 13-MEMBERED MACROLIDES AND USES THEREOF Zikani Therapeutics, Inc. (US) 2026-05-06 EP disclosed
EP-0337944-B1 UREAS CIBA-GEIGY AG (CH) 1993-07-28 EP disclosed
EP-0337944-A1 Ureas CIBA-GEIGY AG (CH) 1989-10-18 EP 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 (8 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-11434247-B1 Substituted furanopyrimidine compounds as PDE1 inhibitors PDE4A, PDE5A, PDE3A POLB 1067/4885SMN1; SMN2 68/4885HTR2C 2093/4885
US-20110201628-A1 HETEROCYCLIC JAK KINASE INHIBITORS JAK2, JAK1, JAK3 POLB 2062/4885SMN1; SMN2 4368/4885HTR2C 2915/4885
US-20190105307-A1 NOVEL COMPOUNDS AND COMPOSITIONS FOR THE INHIBITION OF NAMPT NAMPT, NNMT, NQO1 POLB 2930/4885SMN1; SMN2 1497/4885HTR2C 3033/4885
US-20170368039-A1 NOVEL COMPOUNDS AND COMPOSITIONS FOR THE INHIBITION OF NAMPT NAMPT, NNMT, NQO1 POLB 2930/4885SMN1; SMN2 1497/4885HTR2C 3033/4885
US-20140294805-A1 NOVEL COMPOUNDS AND COMPOSITIONS FOR THE INHIBITION OF NAMPT NAMPT, NNMT, NQO1 POLB 2930/4885SMN1; SMN2 1497/4885HTR2C 3033/4885
US-10772874-B2 Compounds and compositions for the inhibition of NAMPT NAMPT, NNMT, NQO1 POLB 1931/4885SMN1; SMN2 1001/4885HTR2C 3002/4885
US-10272072-B2 Compounds and compositions for the inhibition of NAMPT NAMPT, NNMT, NQO1 POLB 1931/4885SMN1; SMN2 1001/4885HTR2C 3002/4885
US-10456382-B2 Compounds and compositions for the inhibition of NAMPT NAMPT, NNMT, NQO1 POLB 1931/4885SMN1; SMN2 1001/4885HTR2C 3002/4885

“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.