SCHEMBL2715835

SCHEMBL2715835

CC(=O)Nc1cc(C(=O)NC(C)c2cccc(OC(F)(F)F)c2)cc(C)n1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 8/20 0.53
GPR139 Q6DWJ6 1/20 0.49
MAPK1 P28482 2/20 0.47
ADORA3 P0DMS8 1/20 0.45
ROCK2 O75116 6/20 0.44
ROCK1 Q13464 5/20 0.44
PRKG1 Q13976 3/20 0.43
CYP2C9 P11712 2/20 0.43
PRKACA P17612 2/20 0.43
PRKACG P22612 1/20 0.43
PRKACB P22694 1/20 0.43
AKT1 P31749 1/20 0.43
CYP3A4 P08684 1/20 0.43
CYP2D6 P10635 1/20 0.43
CHEK1 O14757 1/20 0.43
RPS6KA5 O75582 1/20 0.43
PRKCG P05129 1/20 0.43
CDK1 P06493 1/20 0.43
RPS6KB1 P23443 1/20 0.43
CDK2 P24941 1/20 0.43

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
SCHEMBL2713507 0.92 RIPK1 (0.46) RIPK1GPR139MAPK1ROCK2ROCK1
SCHEMBL2718076 0.92 RIPK1 (0.46) RIPK1GPR139MAPK1ROCK2ROCK1
SCHEMBL2713506 0.92 RIPK1 (0.46) RIPK1GPR139MAPK1ROCK2ROCK1
SCHEMBL2716853 0.91 MAPK1 (0.47) RIPK1GPR139MAPK1ROCK2ROCK1
SCHEMBL2718978 0.90 MAPK1 (0.46) RIPK1GPR139MAPK1ROCK2ROCK1
SCHEMBL2715168 0.90 GPR139 (0.49) RIPK1GPR139MAPK1ROCK2ROCK1
SCHEMBL2715313 0.89 PDE2A (0.54) RIPK1GPR139MAPK1ADORA3PDE2A
SCHEMBL2715311 0.89 PDE2A (0.54) RIPK1GPR139MAPK1ADORA3PDE2A
SCHEMBL2714511 0.89 POLB (0.45) RIPK1GPR139MAPK1ROCK2ROCK1
SCHEMBL2714808 0.88 ROCK2 (0.44) RIPK1MAPK1ROCK2ROCK1PRKG1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2630122-B1 ARYLAMIDE DERIVATIVES AS TTX-S BLOCKERS RAQUALIA PHARMA INC (JP) 2016-11-30 EP claimed
US-9302991-B2 Arylamide derivatives as TTX-S blockers RAQUALIA PHARMA INC. (JP) 2016-04-05 US claimed
US-20140336377-A1 ARYLAMIDE DERIVATIVES AS TTX-S BLOCKERS RAQUALIA PHARMA INC. (JP) 2014-11-13 US claimed
EP-2630122-A1 ARYLAMIDE DERIVATIVES AS TTX-S BLOCKERS RaQualia Pharma Inc (JP) 2013-08-28 EP claimed
WO-2012053186-A1 ARYLAMIDE DERIVATIVES AS TTX-S BLOCKERS RAQUALIA PHARMA INC. (JP) 2012-04-26 WO claimed
CN-106478497-B Arylamine derivatives as TTX-S blockers 拉夸里亚创药株式会社 2020-05-08 CN disclosed
EP-2630122-B1 ARYLAMIDE DERIVATIVES AS TTX-S BLOCKERS RAQUALIA PHARMA INC (JP) 2016-11-30 EP disclosed
EP-2630122-B1 ARYLAMIDE DERIVATIVES AS TTX-S BLOCKERS RAQUALIA PHARMA INC (JP) 2016-11-30 EP disclosed
US-9302991-B2 Arylamide derivatives as TTX-S blockers RAQUALIA PHARMA INC. (JP) 2016-04-05 US disclosed
US-20140336377-A1 ARYLAMIDE DERIVATIVES AS TTX-S BLOCKERS RAQUALIA PHARMA INC. (JP) 2014-11-13 US disclosed
US-20140336377-A1 ARYLAMIDE DERIVATIVES AS TTX-S BLOCKERS RAQUALIA PHARMA INC. (JP) 2014-11-13 US disclosed
EP-2630122-A1 ARYLAMIDE DERIVATIVES AS TTX-S BLOCKERS RaQualia Pharma Inc (JP) 2013-08-28 EP disclosed
WO-2012053186-A1 ARYLAMIDE DERIVATIVES AS TTX-S BLOCKERS RAQUALIA PHARMA INC. (JP) 2012-04-26 WO disclosed
WO-2012053186-A1 ARYLAMIDE DERIVATIVES AS TTX-S BLOCKERS RAQUALIA PHARMA INC. (JP) 2012-04-26 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 (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-20140336377-A1 ARYLAMIDE DERIVATIVES AS TTX-S BLOCKERS SCN2B, SCN1B, SCN2A RIPK1 4666/4885GPR139 890/4885MAPK1 3779/4885

“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.