SCHEMBL7367686

SCHEMBL7367686

Cc1cccc(C)c1NC(=O)c1ccc([N+](=O)[O-])cc1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RORC P51449 1/20 0.63
RAB9A P51151 4/20 0.61
SMN1; SMN2 Q16637 3/20 0.61
GAA P10253 1/20 0.61
KMT2A Q03164 4/20 0.58
MEN1 O00255 3/20 0.58
MAPT P10636 2/20 0.58
NPC1 O15118 3/20 0.56
MITF O75030 1/20 0.56
POLB P06746 1/20 0.56
HTT P42858 3/20 0.56
ALDH1A1 P00352 2/20 0.56
LMNA P02545 1/20 0.56
L3MBTL1 Q9Y468 1/20 0.53
MAOA P21397 1/20 0.53
MAOB P27338 1/20 0.53
CYP11B1 P15538 1/20 0.52
CYP11B2 P19099 1/20 0.52
HPGD P15428 1/20 0.52
S1PR4 O95977 1/20 0.51

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
SCHEMBL18610497 0.90 RORC (0.63) RORCRAB9ASMN1; SMN2GAAKMT2A
SCHEMBL15775205 0.88 RORC (0.54) RORCRAB9ASMN1; SMN2GAAKMT2A
SCHEMBL18585517 0.86 SMN1; SMN2 (0.62) RAB9ASMN1; SMN2GAAKMT2AMEN1
SCHEMBL9232101 0.86 ALOX5 (0.66) RORCSMN1; SMN2KMT2AMEN1HTT
SCHEMBL6866168 0.83 NPC1 (0.71) RORCRAB9ASMN1; SMN2GAAKMT2A
SCHEMBL7408604 0.81 HTT (0.49) RORCRAB9ASMN1; SMN2GAAMAPT
SCHEMBL8521515 0.81 MEN1 (0.60) RORCRAB9ASMN1; SMN2GAAKMT2A
SCHEMBL14777468 0.81 KMT2A (0.66) RAB9ASMN1; SMN2GAAKMT2AMEN1
SCHEMBL10599217 0.81 MEN1 (0.64) RAB9ASMN1; SMN2GAAKMT2AMEN1
SCHEMBL14075258 0.80 NPC1 (0.59) RAB9ASMN1; SMN2KMT2AMEN1MAPT

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-6211242-B1 CARDIOVASCULAR DISORDERS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2001-04-03 US disclosed
EP-0757670-B1 BENZAMIDE DERIVATIVES AS VASOPRESSIN ANTAGONISTS FUJISAWA PHARMACEUTICAL CO (JP) 1999-01-13 EP disclosed
EP-0757670-A1 BENZAMIDE DERIVATIVES AS VASOPRESSIN ANTAGONISTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1997-02-12 EP disclosed
WO-1995029152-A1 BENZAMIDE DERIVATIVES AS VASOPRESSIN ANTAGONISTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1995-11-02 WO disclosed
US-5064862-A 4-Amino-2*,6*-Dimethylbenzanilide RESEARCH CORPORATION (US) 1991-11-12 US disclosed
EP-0213572-B1 3-AND 4-AMINO-N(ALKYL PHENYL) BENZAMIDE COMPOUNDS AND COMPOSITION CONTAINING SAME AS ANTICONVULSANT DRUGS Research Corporation Technologies, Inc. (a Delaware corp.) (US) 1991-07-03 EP disclosed
EP-0213572-A1 3-and 4-amino-N(alkyl phenyl) benzamide compounds and composition containing same as anticonvulsant drugs Research Corporation Technologies, Inc. (a Delaware corp.) (US) 1987-03-11 EP disclosed
US-4638014-A AMINOBENZANILIDES RESEARCH CORPORATION (US) 1987-01-20 US disclosed