SCHEMBL7653525

SCHEMBL7653525

CC1(c2cccc3ccccc23)C(=O)N(CCCc2cncn2Cc2ccc(C#N)cc2)C(=O)N1CC(=O)O.[LiH]

nearest known ligand 0.59

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
FNTA P49354 19/20 0.59
FNTB P49356 19/20 0.59
CYP11B1 P15538 1/20 0.47
CYP11B2 P19099 1/20 0.47
PGGT1B P53609 2/20 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
SCHEMBL7661055 0.99 FNTA (0.60) FNTAFNTBCYP11B1CYP11B2PGGT1B
Lithium SCHEMBL7653538 0.99 FNTA (0.59) FNTAFNTBCYP11B1CYP11B2PGGT1B
Lithium Ion SCHEMBL7653530 0.92 FNTA (0.58) FNTAFNTBCYP11B1CYP11B2PGGT1B
SCHEMBL7654971 0.92 FNTA (0.68) FNTAFNTBCYP11B1CYP11B2
SCHEMBL7657532 0.91 FNTA (0.64) FNTAFNTBCYP11B1CYP11B2
SCHEMBL7659414 0.90 FNTA (0.63) FNTAFNTBCYP11B1CYP11B2
SCHEMBL7658359 0.90 FNTA (0.73) FNTAFNTBCYP11B1CYP11B2PGGT1B
SCHEMBL7655758 0.89 FNTA (0.61) FNTAFNTBCYP11B1CYP11B2
SCHEMBL7654962 0.88 FNTA (0.59) FNTAFNTBCYP11B1CYP11B2PGGT1B
SCHEMBL7653602 0.88 FNTA (0.67) FNTAFNTBCYP11B1CYP11B2

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
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