SCHEMBL2477550

SCHEMBL2477550

CC(C)(C)OC(=O)Nc1ccccc1NC(=O)c1ccc(CN(CCCN2CCOCC2)C(=O)Nc2ccc([N+](=O)[O-])cc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 1/20 0.48
OPRD1 P41143 1/20 0.48
CD274 Q9NZQ7 1/20 0.47
CYP2D6 P10635 1/20 0.47
CYP2C9 P11712 1/20 0.47
USP2 O75604 1/20 0.46
NAMPT P43490 4/20 0.45
TSHR P16473 2/20 0.45
MAPT P10636 4/20 0.45
ALDH1A1 P00352 1/20 0.45
ROCK2 O75116 1/20 0.43
TP53 P04637 1/20 0.43
THRB P10828 1/20 0.43
ABCG2 Q9UNQ0 1/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 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
SCHEMBL2479082 0.91 OPRM1 (0.51) OPRM1OPRD1CD274USP2NAMPT
SCHEMBL2479576 0.90 OPRM1 (0.50) OPRM1OPRD1CD274USP2NAMPT
SCHEMBL2475705 0.90 KDM1A (0.51) OPRM1OPRD1CD274USP2NAMPT
SCHEMBL4396390 0.90 OPRM1 (0.50) OPRM1OPRD1CD274USP2NAMPT
SCHEMBL3829337 0.90 OPRM1 (0.52) OPRM1OPRD1CD274USP2NAMPT
SCHEMBL3836032 0.89 OPRM1 (0.49) OPRM1OPRD1CD274USP2NAMPT
SCHEMBL2475604 0.89 USP2 (0.51) OPRM1OPRD1CD274USP2NAMPT
SCHEMBL2502519 0.89 OPRM1 (0.49) OPRM1OPRD1CD274USP2NAMPT
SCHEMBL2478335 0.88 USP2 (0.48) OPRM1OPRD1CD274USP2NAMPT
SCHEMBL2476835 0.88 OPRM1 (0.48) OPRM1OPRD1CD274USP2NAMPT

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 6 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-8076332-B2 N- (2-aminophenyl) benzamide derivative having urea structure SANTEN PHARMACEUTICAL CO., LTD. (JP) 2011-12-13 US disclosed
EP-2107052-B1 NOVEL N-(2-AMINOPHENYL)BENZAMIDE DERIVATIVE HAVING AN UREA STRUCTURE SANTEN PHARMACEUTICAL CO LTD (JP) 2011-10-12 EP disclosed
US-20090306077-A1 NOVEL N- (2-AMINOPHENYL) BENZAMIDE DERIVATIVE HAVING UREA STRUCTURE SANTEN PHARMACEUTICAL CO., LTD. (JP) 2009-12-10 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 OPRM1 1105/4885OPRD1 1211/4885CD274 4808/4885

“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.