SCHEMBL7654667

SCHEMBL7654667

COC(=O)C[C@H]1C(=O)N(Cc2cncn2Cc2ccc(C#N)cc2)C(=O)N1Cc1cccc2ccccc12

nearest known ligand 0.51

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 3/20 0.51
CYP11B2 P19099 3/20 0.51
FNTA P49354 8/20 0.47
FNTB P49356 8/20 0.47
PGGT1B P53609 6/20 0.46
HDAC6 Q9UBN7 1/20 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
SCHEMBL7653501 0.93 FNTA (0.48) CYP11B1CYP11B2FNTAFNTBPGGT1B
SCHEMBL7656235 0.91 FNTA (0.48) CYP11B1CYP11B2FNTAFNTBPGGT1B
SCHEMBL7654486 0.88 CYP11B1 (0.45) CYP11B1CYP11B2FNTAFNTBPGGT1B
SCHEMBL7656322 0.87 FNTA (0.44) CYP11B1CYP11B2FNTAFNTBPGGT1B
SCHEMBL7655477 0.85 FNTA (0.56) CYP11B1CYP11B2FNTAFNTBPGGT1B
SCHEMBL7656246 0.85 FNTA (0.48) FNTAFNTBPGGT1B
SCHEMBL7658529 0.83 FNTA (0.43) CYP11B1CYP11B2FNTAFNTBPGGT1B
SCHEMBL7658522 0.83 FNTA (0.55) FNTAFNTBPGGT1BHDAC6
SCHEMBL7654002 0.80 HDAC6 (0.51) CYP11B1CYP11B2FNTAFNTBPGGT1B
SCHEMBL7658616 0.78 FNTA (0.46) CYP11B1CYP11B2FNTAFNTBPGGT1B

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
US-6384061-B1 HYDANTOIN COMPOUNDS REPRESENTED BY FORMULA (I) WHICH SHOWS AN INHIBITORY ACTIVITY AGAINST FARNESYL TRANSFERASE, AND THUS CAN BE USED AS AN ANTI-CANCER AGENT, OR PHARMACEUTICALLY ACCEPTABLE SALTS LG CHEMICAL LTD. (KR) 2002-05-07 US claimed
US-6384061-B1 HYDANTOIN COMPOUNDS REPRESENTED BY FORMULA (I) WHICH SHOWS AN INHIBITORY ACTIVITY AGAINST FARNESYL TRANSFERASE, AND THUS CAN BE USED AS AN ANTI-CANCER AGENT, OR PHARMACEUTICALLY ACCEPTABLE SALTS LG CHEMICAL LTD. (KR) 2002-05-07 US disclosed