SCHEMBL6984572

SCHEMBL6984572

COC(=O)[C@H](CC(C)C)NC(=O)c1cn(Cc2cncn2Cc2ccc(C#N)cc2)cc1-c1cccc2ccccc12

nearest known ligand 0.60

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FNTA P49354 10/20 0.49
FNTB P49356 10/20 0.49
PGGT1B P53609 4/20 0.48
CYP11B1 P15538 1/20 0.47
CYP11B2 P19099 1/20 0.47
CYP3A4 P08684 1/20 0.46

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
SCHEMBL6973565 0.93 FNTA (0.52) FNTAFNTBPGGT1BCYP3A4
SCHEMBL6978130 0.90 FNTA (0.61) FNTAFNTBPGGT1BCYP11B1CYP11B2
SCHEMBL6983912 0.85 FNTA (0.63) FNTAFNTBPGGT1B
SCHEMBL6923475 0.82 FNTA (0.63) FNTAFNTBPGGT1BCYP3A4
SCHEMBL6974463 0.81 FNTA (0.61) FNTAFNTBPGGT1BCYP3A4
SCHEMBL6926980 0.80 FNTA (0.73) FNTAFNTBPGGT1BCYP3A4
SCHEMBL6977096 0.78 FNTA (0.65) FNTAFNTBPGGT1BCYP3A4
SCHEMBL6978089 0.78 FNTA (0.73) FNTAFNTBPGGT1BCYP3A4
SCHEMBL6984217 0.77 FNTA (0.55) FNTAFNTBPGGT1BCYP3A4
SCHEMBL6983546 0.77 FNTA (0.59) FNTAFNTBPGGT1BCYP3A4

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-1045846-B1 IMIDAZOLE DERIVATIVES HAVING AN INHIBITORY ACTIVITY FOR FARNESYL TRANSFERASE AND PROCESS FOR PREPARATION THEREOF LG CHEMICAL LTD (KR) 2003-05-02 EP claimed
US-6268363-B1 ANTITUMOR LG CHEMICAL LTD. (KR) 2001-07-31 US claimed