SCHEMBL1496837

SCHEMBL1496837

CN(C)CCC(NC(=O)Nc1cccc(F)c1)c1ccc(C(=O)Nc2cscc2NC(=O)OC(C)(C)C)nc1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
UTS2R Q9UKP6 8/20 0.46
MCHR1 Q99705 1/20 0.38
ROCK2 O75116 2/20 0.38
ROCK1 Q13464 2/20 0.38
KIT P10721 1/20 0.37
DDR2 Q16832 1/20 0.37
MTOR P42345 1/20 0.36
CDC42BPA Q5VT25 1/20 0.36
ATM Q13315 1/20 0.35
OPRM1 P35372 1/20 0.35
AURKA O14965 2/20 0.34
RPS6KB1 P23443 2/20 0.34
AURKB Q96GD4 2/20 0.34
RXFP1 Q9HBX9 1/20 0.34

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
SCHEMBL1496869 0.96 UTS2R (0.41) UTS2RMCHR1ROCK2ROCK1KIT
SCHEMBL3230618 0.94 UTS2R (0.47) UTS2RMCHR1ROCK2ROCK1KIT
SCHEMBL10476392 0.92 UTS2R (0.47) UTS2RROCK2ROCK1ATM
SCHEMBL1496871 0.91 UTS2R (0.47) UTS2RMCHR1ROCK2ROCK1
SCHEMBL11899970 0.90 UTS2R (0.59) UTS2RROCK2ROCK1
SCHEMBL3226027 0.90 UTS2R (0.42) UTS2RMCHR1ROCK2ROCK1KIT
SCHEMBL1497033 0.89 UTS2R (0.44) UTS2RROCK2ROCK1OPRM1
SCHEMBL11899891 0.89 UTS2R (0.44) UTS2RROCK2ROCK1
SCHEMBL3230267 0.89 UTS2R (0.41) UTS2RMCHR1ROCK2ROCK1KIT
SCHEMBL3262063 0.88 UTS2R (0.41) UTS2RMCHR1ROCK2ROCK1KIT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120202808-A1 NOVEL THIOPHENEDIAMINE DERIVATIVE HAVING UREA STRUCTURE SANTEN PHARMACEUTICAL CO., LTD. (JP) 2012-08-09 US disclosed
EP-2292611-A1 NOVEL THIOPHENEDIAMINE DERIVATIVE HAVING UREA STRUCTURE Santen Pharmaceutical Co., Ltd (JP) 2011-03-09 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-20120202808-A1 NOVEL THIOPHENEDIAMINE DERIVATIVE HAVING UREA STRUCTURE CBR1, NAT1, PRMT1 UTS2R 195/4885MCHR1 137/4885ROCK2 3193/4885

“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.