SCHEMBL9052592

SCHEMBL9052592

CN(Cc1ccccc1)C(=O)C(CN)NC(=O)Cc1cncn1Cc1ccc(C#N)cc1.Cc1cccc(CNC(=O)C(CN)NC(=O)Cc2cncn2Cc2ccc(C#N)cc2)c1

nearest known ligand 0.47

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
FNTA P49354 14/20 0.47
FNTB P49356 14/20 0.47
PGGT1B P53609 3/20 0.45
CYP11B1 P15538 2/20 0.42
CYP11B2 P19099 2/20 0.42

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
SCHEMBL8391968 0.92 FNTA (0.51) FNTAFNTBPGGT1BCYP11B1CYP11B2
SCHEMBL8392299 0.90 FNTA (0.51) FNTAFNTBPGGT1BCYP11B1CYP11B2
SCHEMBL8392306 0.90 FNTA (0.51) FNTAFNTBPGGT1BCYP11B1CYP11B2
SCHEMBL9052174 0.86 FNTA (0.46) FNTAFNTBPGGT1BCYP11B1CYP11B2
SCHEMBL9058692 0.82 FNTA (0.49) FNTAFNTBPGGT1BCYP11B1CYP11B2
SCHEMBL8388787 0.80 FNTA (0.48) FNTAFNTBPGGT1BCYP11B1CYP11B2
SCHEMBL8388840 0.79 FNTA (0.48) FNTAFNTBPGGT1BCYP11B1CYP11B2
SCHEMBL9052035 0.79 FNTA (0.48) FNTAFNTBPGGT1BCYP11B1CYP11B2
SCHEMBL8392096 0.78 FNTA (0.52) FNTAFNTBPGGT1BCYP11B1CYP11B2
SCHEMBL8389011 0.72 FNTA (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 1 patent. 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