SCHEMBL2477227

SCHEMBL2477227

Nc1ccccc1NC(=O)c1ccc(CN(CCCN2CCOCC2)C(=O)Nc2ccc(F)cc2)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 1/20 0.52
OPRD1 P41143 1/20 0.52
HSD17B10 Q99714 4/20 0.52
KDM4E B2RXH2 4/20 0.52
ALDH1A1 P00352 4/20 0.52
HPGD P15428 3/20 0.52
SMN1; SMN2 Q16637 3/20 0.52
ALOX15 P16050 1/20 0.52
MAPK1 P28482 1/20 0.52
NPC1 O15118 1/20 0.52
RAB9A P51151 1/20 0.52
TSHR P16473 2/20 0.51
NAMPT P43490 3/20 0.51
LMNA P02545 1/20 0.51
ATM Q13315 1/20 0.51
MAPT P10636 1/20 0.51
HDAC1 Q13547 4/20 0.50
KDM1A O60341 1/20 0.49
HDAC3 O15379 1/20 0.48
HDAC4 P56524 1/20 0.48

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
SCHEMBL2475852 0.93 OPRM1 (0.53) OPRM1OPRD1HSD17B10TSHRNAMPT
SCHEMBL2478140 0.93 HSD17B10 (0.52) OPRM1OPRD1HSD17B10KDM4EALDH1A1
SCHEMBL2476586 0.92 HSD17B10 (0.55) OPRM1OPRD1HSD17B10KDM4EALDH1A1
SCHEMBL2477106 0.92 OPRM1 (0.54) OPRM1OPRD1HSD17B10KDM4EALDH1A1
SCHEMBL2473469 0.92 HDAC1 (0.61) OPRM1OPRD1TSHRNAMPTHDAC1
SCHEMBL2473813 0.91 HDAC1 (0.51) KDM4EALDH1A1HPGDLMNAMAPT
SCHEMBL2470965 0.90 OPRM1 (0.53) OPRM1OPRD1HSD17B10ALDH1A1TSHR
SCHEMBL2478739 0.90 OPRM1 (0.55) OPRM1OPRD1SMN1; SMN2MAPK1TSHR
SCHEMBL2473980 0.90 ALDH1A1 (0.54) OPRM1OPRD1HSD17B10KDM4EALDH1A1
SCHEMBL2473792 0.90 ALDH1A1 (0.54) OPRM1OPRD1HSD17B10KDM4EALDH1A1

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 8 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
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
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 1211/4885HSD17B10 2033/4885

“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.