SCHEMBL6617952

SCHEMBL6617952

CC(=O)N1Cc2cc(-c3ccncc3)ccc2NCC1Cc1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FNTA P49354 9/20 0.46
FNTB P49356 9/20 0.46
DAGLB Q8NCG7 1/20 0.41
DAGLA Q9Y4D2 1/20 0.41
ABCB1 P08183 4/20 0.41
ROCK1 Q13464 1/20 0.39
GPR142 Q7Z601 1/20 0.38
MAPK3 P27361 1/20 0.37
MAPK1 P28482 1/20 0.37
HSD17B3 P37058 1/20 0.37
PDE3B Q13370 1/20 0.37
PDE3A Q14432 1/20 0.37
CYP46A1 Q9Y6A2 1/20 0.37

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
SCHEMBL6633403 0.94 FNTA (0.45) FNTAFNTBABCB1HSD17B3
SCHEMBL6634139 0.94 FNTA (0.45) FNTAFNTBABCB1HSD17B3
SCHEMBL6632636 0.83 FNTA (0.56) FNTAFNTBABCB1HSD17B3
SCHEMBL6613663 0.82 FNTA (0.62) FNTAFNTBDAGLBDAGLAGPR142
SCHEMBL6637542 0.82 FNTA (0.62) FNTAFNTBDAGLBDAGLAGPR142
SCHEMBL6615989 0.81 FNTA (0.39) FNTAFNTBDAGLBDAGLAABCB1
SCHEMBL6635535 0.81 FNTA (0.39) FNTAFNTBDAGLBDAGLAABCB1
SCHEMBL6613662 0.80 FNTA (0.43) FNTAFNTBDAGLBDAGLAROCK1
SCHEMBL6633140 0.77 FNTA (0.47) FNTAFNTBDAGLBDAGLAABCB1
SCHEMBL3500354 0.76 FNTA (0.56) FNTAFNTB

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
EP-1481975-A1 Inhibitors of farnesyl protein transferase BRISTOL-MYERS SQUIBB COMPANY (US) 2004-12-01 EP disclosed
EP-0892797-A4 INHIBITORS OF FARNESYL PROTEIN TRANSFERASE BRISTOL MYERS SQUIBB CO (US) 2004-10-20 EP disclosed
US-6455523-B1 ADMINISTERING 1,4-BENZODIAZEPINE DERIVATIVE AS ANTITUMOR OR ANTICARCINOGENIC AGENT BRISTOL-MYERS SQUIBB COMPANY 2002-09-24 US disclosed
US-6011029-A BENZODIAZEPINE COMPOUNDS BRISTOL-MYERS SQUIBB COMPANY (US) 2000-01-04 US disclosed
EP-0892797-A1 INHIBITORS OF FARNESYL PROTEIN TRANSFERASE BRISTOL-MYERS SQUIBB COMPANY (US) 1999-01-27 EP disclosed
WO-1997030992-A1 INHIBITORS OF FARNESYL PROTEIN TRANSFERASE BRISTOL-MYERS SQUIBB COMPANY (US) 1997-08-28 WO disclosed