SCHEMBL9058692

SCHEMBL9058692

CN(Cc1ccccc1)C(=O)C(CNC(=O)Cc1ccccc1)NC(=O)Cc1cncn1Cc1ccc(C#N)cc1

nearest known ligand 0.49

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
FNTA P49354 14/20 0.49
FNTB P49356 14/20 0.49
CYP11B1 P15538 3/20 0.47
CYP11B2 P19099 3/20 0.47
PGGT1B P53609 4/20 0.44

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
SCHEMBL8392096 0.90 FNTA (0.52) FNTAFNTBCYP11B1CYP11B2PGGT1B
SCHEMBL8392306 0.90 FNTA (0.51) FNTAFNTBCYP11B1CYP11B2PGGT1B
SCHEMBL8392299 0.90 FNTA (0.51) FNTAFNTBCYP11B1CYP11B2PGGT1B
SCHEMBL9052592 0.82 FNTA (0.47) FNTAFNTBCYP11B1CYP11B2PGGT1B
SCHEMBL8388772 0.80 FNTA (0.46) FNTAFNTBCYP11B1CYP11B2PGGT1B
SCHEMBL8388776 0.76 CYP11B1 (0.52) FNTAFNTBCYP11B1CYP11B2PGGT1B
SCHEMBL9051587 0.74 FNTA (0.47) FNTAFNTBCYP11B1CYP11B2PGGT1B
SCHEMBL8389012 0.74 FNTA (0.49) FNTAFNTBCYP11B1CYP11B2PGGT1B
SCHEMBL9052376 0.74 FNTA (0.47) FNTAFNTBCYP11B1CYP11B2PGGT1B
SCHEMBL8389739 0.74 FNTA (0.47) FNTAFNTBCYP11B1CYP11B2PGGT1B

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
WO-1996039137-A1 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE MERCK & CO., INC. (US) 1996-12-12 WO claimed
WO-1996039137-A1 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE MERCK & CO., INC. (US) 1996-12-12 WO disclosed