SCHEMBL9314264

SCHEMBL9314264

Cc1ccc(C(=O)Nc2ccc3c(c2)NC(=O)CC3(C)C)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.53
KMT2A Q03164 2/20 0.53
NPC1 O15118 7/20 0.51
RAB9A P51151 7/20 0.51
MAPT P10636 5/20 0.51
SMN1; SMN2 Q16637 4/20 0.51
ALDH1A1 P00352 2/20 0.51
NFKB1 P19838 2/20 0.51
NFKB2 Q00653 2/20 0.51
RELA Q04206 2/20 0.51
RARB P10826 3/20 0.51
RARG P13631 3/20 0.51
TP53 P04637 1/20 0.50
CYP3A4 P08684 2/20 0.49
CYP26A1 O43174 2/20 0.49
RARA P10276 2/20 0.49
PGR P06401 1/20 0.49
ADORA3 P0DMS8 1/20 0.49
TBXA2R P21731 1/20 0.49
BLVRB P30043 1/20 0.49

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
SCHEMBL9312256 0.90 RARB (0.51) MEN1KMT2AALDH1A1RARBRARG
SCHEMBL9866488 0.89 TNKS (0.52) MEN1KMT2ANPC1RAB9ASMN1; SMN2
SCHEMBL9865756 0.88 MEN1 (0.55) MEN1KMT2ANPC1RAB9AMAPT
SCHEMBL10587722 0.87 KMT2A (0.56) MEN1KMT2ANPC1RAB9AMAPT
SCHEMBL9314211 0.87 MEN1 (0.50) MEN1KMT2ANPC1RAB9AMAPT
SCHEMBL9313154 0.87 TNKS (0.50) MEN1KMT2ARAB9ASMN1; SMN2RARB
SCHEMBL9313806 0.86 ADORA3 (0.48) MEN1KMT2ANPC1RAB9ASMN1; SMN2
SCHEMBL9312238 0.86 RARB (0.56) MEN1KMT2ANPC1RAB9AMAPT
SCHEMBL13202474 0.85 RARB (0.47) MEN1KMT2ANPC1RAB9AMAPT
SCHEMBL9314396 0.84 RARB (0.54) MEN1KMT2AMAPTALDH1A1RARB

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-5373019-A Pharmaceutical lactam compositions for inhibition of erythrocyte and thrombocyte aggregation BOEHRINGER MANNHEIM GMBH (DE) 1994-12-13 US disclosed
US-4985448-A Ureidoindoles, pharmaceutical compositions and methods for erythrocyte and thrombocyte aggregation inhibition BOEHRINGER MANNHEIM GMBH (DE) 1991-01-15 US disclosed
EP-0327986-A2 Medicaments containing lactams, substituted lactams and process for their preparation Roche Diagnostics GmbH (DE) 1989-08-16 EP disclosed