SCHEMBL3829337

SCHEMBL3829337

COC(=O)c1ccc(NC(=O)N(CCCN2CCOCC2)Cc2ccc(C(=O)Nc3ccccc3NC(=O)OC(C)(C)C)cc2)cc1

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 1/20 0.52
OPRD1 P41143 1/20 0.52
MAPK1 P28482 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
CD274 Q9NZQ7 1/20 0.49
CASR P41180 2/20 0.49
TSHR P16473 2/20 0.48
USP2 O75604 1/20 0.48
NAMPT P43490 4/20 0.48
ROCK2 O75116 1/20 0.47
MAPT P10636 2/20 0.47
TP53 P04637 1/20 0.47
THRB P10828 1/20 0.47
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
KDM1A O60341 1/20 0.44

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
SCHEMBL2475604 0.93 USP2 (0.51) OPRM1OPRD1CD274TSHRUSP2
SCHEMBL2479082 0.93 OPRM1 (0.51) OPRM1OPRD1CD274TSHRUSP2
SCHEMBL2479576 0.93 OPRM1 (0.50) OPRM1OPRD1CD274TSHRUSP2
SCHEMBL4396390 0.93 OPRM1 (0.50) OPRM1OPRD1CD274CASRTSHR
SCHEMBL2475705 0.93 KDM1A (0.51) OPRM1OPRD1MAPK1SMN1; SMN2CD274
SCHEMBL3836032 0.92 OPRM1 (0.49) OPRM1OPRD1CD274TSHRUSP2
SCHEMBL2502519 0.91 OPRM1 (0.49) OPRM1OPRD1CD274CASRTSHR
SCHEMBL2476835 0.91 OPRM1 (0.48) OPRM1OPRD1CD274TSHRUSP2
SCHEMBL2478335 0.91 USP2 (0.48) OPRM1OPRD1CD274TSHRUSP2
SCHEMBL2473939 0.90 TSHR (0.60) OPRM1OPRD1MAPK1SMN1; SMN2CD274

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 7 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
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
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 1211/4885MAPK1 125/4885

“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.