SCHEMBL7535976

SCHEMBL7535976

COc1cccc(CC(=O)N2Cc3ccccc3CC2Cn2cncc2Cc2ccc(C#N)cc2)c1

nearest known ligand 0.51

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FNTA P49354 17/20 0.51
FNTB P49356 17/20 0.51
PGGT1B P53609 3/20 0.40
NR1D1 P20393 1/20 0.39
CYP11B1 P15538 2/20 0.38
CYP11B2 P19099 2/20 0.38

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
SCHEMBL7481387 1.00 FNTA (0.51) FNTAFNTBPGGT1BNR1D1CYP11B1
SCHEMBL7480291 0.89 FNTA (0.52) FNTAFNTBPGGT1BNR1D1
SCHEMBL7480297 0.89 FNTA (0.52) FNTAFNTBPGGT1BNR1D1
SCHEMBL7473823 0.76 FNTA (0.47) FNTAFNTBPGGT1B
SCHEMBL7533374 0.73 FNTA (0.58) FNTAFNTBPGGT1B
SCHEMBL7533369 0.73 FNTA (0.58) FNTAFNTBPGGT1B
SCHEMBL7534933 0.72 FNTA (0.44) FNTAFNTB
SCHEMBL7534925 0.72 FNTA (0.46) FNTAFNTB
SCHEMBL7582240 0.71 FNTA (0.45) FNTAFNTBCYP11B1CYP11B2
SCHEMBL7537123 0.68 FNTA (0.44) FNTAFNTBCYP11B1CYP11B2

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
EP-1045844-A4 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE MERCK & CO INC (US) 2002-08-21 EP disclosed
EP-1045844-A1 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE Merck & Co., Inc. (US) 2000-10-25 EP disclosed
WO-1999028314-A1 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE MERCK & CO., INC. (US) 1999-06-10 WO disclosed