SCHEMBL3273953

SCHEMBL3273953

CC(NC(=O)c1ccccc1)c1nc(-c2ccncn2)cc(=O)n1C

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 16/20 0.49
CYP2D6 P10635 4/20 0.46
ROCK1 Q13464 3/20 0.46
ROCK2 O75116 3/20 0.46
PRKACA P17612 2/20 0.46
RPS6KB1 P23443 2/20 0.46
MAPK1 P28482 2/20 0.46
GSK3A P49840 2/20 0.46
PRKX P51817 2/20 0.46
PRKCD Q05655 2/20 0.46
PRKG1 Q13976 2/20 0.46
PKN2 Q16513 2/20 0.46
CLK4 Q9HAZ1 2/20 0.46
SGK2 Q9HBY8 2/20 0.46
CYP3A4 P08684 2/20 0.46
CYP2C9 P11712 1/20 0.46
PRKCG P05129 1/20 0.46
CYP1A2 P05177 1/20 0.42
RPS6KA5 O75582 1/20 0.41
MAP4K4 O95819 1/20 0.41

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
SCHEMBL3279423 0.83 GSK3B (0.47) GSK3BCYP2D6ROCK1ROCK2PRKACA
SCHEMBL3145032 0.82 GSK3B (0.41) GSK3BCYP2D6ROCK1ROCK2PRKACA
SCHEMBL3145051 0.82 BRD4 (0.44) GSK3BCYP2D6ROCK1ROCK2PRKACA
SCHEMBL3273306 0.80 GSK3B (0.50) GSK3BCYP2D6ROCK2CYP3A4CYP1A2
SCHEMBL3275123 0.79 GSK3B (0.44) GSK3BCYP2D6ROCK1ROCK2PRKACA
SCHEMBL3274484 0.78 GSK3B (0.41) GSK3BCYP2D6ROCK1ROCK2CYP3A4
SCHEMBL3274773 0.78 GSK3B (0.52) GSK3BCYP2D6ROCK1ROCK2CYP1A2
SCHEMBL3273383 0.78 GSK3B (0.41) GSK3BCYP2D6ROCK1ROCK2PRKACA
SCHEMBL3273980 0.78 GSK3B (0.41) GSK3BCYP2D6ROCK1ROCK2PRKACA
SCHEMBL3273302 0.78 CYP3A4 (0.46) GSK3BCYP2D6ROCK1ROCK2PRKACA

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 12 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8592436-B2 Arylamide pyrimidone derivatives SANOFI (FR) 2013-11-26 US claimed
EP-2148866-B1 ARYLAMIDE PYRIMIDONE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES SANOFI SA (FR) 2013-07-17 EP claimed
US-20100087460-A1 ARYLAMIDE PYRIMIDONE DERIVATIVES SANOFI-AVENTIS (FR) 2010-04-08 US claimed
EP-2148866-A2 ARYLAMIDE PYRIMIDONE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES Sanofi-Aventis (FR) 2010-02-03 EP claimed
WO-2008155669-A2 ARYLAMIDE PYRIMIDONE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES SANOFI-AVENTIS (FR) 2008-12-24 WO claimed
EP-1992620-A1 Arylamide pyrimidone derivatives for the treatment of neurodegenerative diseases Sanofi-Aventis (FR) 2008-11-19 EP claimed
US-8592436-B2 Arylamide pyrimidone derivatives SANOFI (FR) 2013-11-26 US disclosed
EP-2148866-B1 ARYLAMIDE PYRIMIDONE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES SANOFI SA (FR) 2013-07-17 EP disclosed
US-20100087460-A1 ARYLAMIDE PYRIMIDONE DERIVATIVES SANOFI-AVENTIS (FR) 2010-04-08 US disclosed
EP-2148866-A2 ARYLAMIDE PYRIMIDONE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES Sanofi-Aventis (FR) 2010-02-03 EP disclosed
WO-2008155669-A2 ARYLAMIDE PYRIMIDONE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES SANOFI-AVENTIS (FR) 2008-12-24 WO disclosed
EP-1992620-A1 Arylamide pyrimidone derivatives for the treatment of neurodegenerative diseases Sanofi-Aventis (FR) 2008-11-19 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 (1 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-20100087460-A1 ARYLAMIDE PYRIMIDONE DERIVATIVES DHFR, XDH, HPRT1 GSK3B 3247/4885CYP2D6 64/4885ROCK1 2302/4885

“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.