SCHEMBL3829610

SCHEMBL3829610

CC(C)(C)OC(=O)Nc1ccccc1NC(=O)c1ccc(C(CCO)NC(=O)Nc2ccccc2)cc1

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ROCK2 O75116 1/20 0.46
HDAC1 Q13547 10/20 0.45
NAMPT P43490 1/20 0.43
CTSK P43235 1/20 0.41
PRKACA P17612 1/20 0.41
CDK8 P49336 1/20 0.41
GSK3A P49840 1/20 0.41
GSK3B P49841 1/20 0.41
PRKX P51817 1/20 0.41
PRKCQ Q04759 1/20 0.41
ROCK1 Q13464 1/20 0.41
CLK4 Q9HAZ1 1/20 0.41
UTS2R Q9UKP6 3/20 0.40
HDAC3 O15379 5/20 0.40
HDAC2 Q92769 5/20 0.40
NCOR2 Q9Y618 4/20 0.39
RXFP1 Q9HBX9 1/20 0.38

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
SCHEMBL3835550 0.91 HDAC1 (0.44) HDAC1NAMPTCTSKUTS2RHDAC3
SCHEMBL3834386 0.90 HDAC1 (0.45) HDAC1NAMPTCTSKUTS2RHDAC3
SCHEMBL3832774 0.90 UTS2R (0.53) ROCK2ROCK1UTS2R
SCHEMBL2477489 0.86 CTSK (0.44) HDAC1CTSKHDAC2
SCHEMBL2477558 0.83 UTS2R (0.52) ROCK2HDAC1ROCK1UTS2R
SCHEMBL2471674 0.83 UTS2R (0.52) ROCK2HDAC1ROCK1UTS2R
SCHEMBL2476917 0.82 UTS2R (0.61) ROCK2ROCK1UTS2R
SCHEMBL2472962 0.82 HDAC1 (0.44) ROCK2HDAC1NAMPTROCK1UTS2R
SCHEMBL2480439 0.82 UTS2R (0.47) ROCK2HDAC1ROCK1UTS2R
SCHEMBL2479536 0.81 HDAC1 (0.61) HDAC1HDAC3HDAC2NCOR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8076332-B2 N- (2-aminophenyl) benzamide derivative having urea structure SANTEN PHARMACEUTICAL CO., LTD. (JP) 2011-12-13 US disclosed
US-20090306077-A1 NOVEL N- (2-AMINOPHENYL) BENZAMIDE DERIVATIVE HAVING UREA STRUCTURE SANTEN PHARMACEUTICAL CO., LTD. (JP) 2009-12-10 US disclosed
EP-2107052-A1 NOVEL N-(2-AMINOPHENYL)BENZAMIDE DERIVATIVE HAVING AN UREA STRUCTURE Santen Pharmaceutical Co., Ltd (JP) 2009-10-07 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-20090306077-A1 NOVEL N- (2-AMINOPHENYL) BENZAMIDE DERIVATIVE HAVING UREA STRUCTURE UACA, SLC14A1, ARG2 ROCK2 499/4885HDAC1 200/4885NAMPT 3896/4885

“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.