SCHEMBL8433675

SCHEMBL8433675

CC(=O)CCC(C)C(CNCc1ccccc1Cl)NC(=O)Cc1cncn1Cc1ccc(C#N)cc1

nearest known ligand 0.47

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
FNTA P49354 15/20 0.47
FNTB P49356 15/20 0.47
PGGT1B P53609 8/20 0.47
CYP11B1 P15538 3/20 0.45
CYP11B2 P19099 3/20 0.45

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
SCHEMBL8297155 0.91 FNTA (0.46) FNTAFNTBPGGT1BCYP11B1CYP11B2
SCHEMBL8387732 0.86 CYP11B1 (0.45) FNTAFNTBPGGT1BCYP11B1CYP11B2
SCHEMBL8387731 0.86 CYP11B1 (0.45) FNTAFNTBPGGT1BCYP11B1CYP11B2
SCHEMBL8387804 0.85 FNTA (0.45) FNTAFNTBPGGT1BCYP11B1CYP11B2
SCHEMBL8495647 0.85 CYP11B1 (0.47) FNTAFNTBPGGT1BCYP11B1CYP11B2
SCHEMBL8499303 0.82 FNTA (0.47) FNTAFNTBPGGT1BCYP11B1CYP11B2
SCHEMBL8499308 0.82 FNTA (0.47) FNTAFNTBPGGT1BCYP11B1CYP11B2
SCHEMBL8501376 0.81 CYP11B1 (0.44) FNTAFNTBPGGT1BCYP11B1CYP11B2
SCHEMBL8501373 0.81 CYP11B1 (0.44) FNTAFNTBPGGT1BCYP11B1CYP11B2
SCHEMBL8498084 0.81 CYP11B1 (0.49) FNTAFNTBPGGT1BCYP11B1CYP11B2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0833633-A4 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE MERCK & CO INC (US) 1999-03-24 EP claimed
EP-0833633-A1 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE Merck & Co., Inc. (US) 1998-04-08 EP claimed