SCHEMBL8762235

SCHEMBL8762235

CC[C@H](C)[C@@H](CN(CC(=O)N[C@@H](CCSC)C(=O)O)Cc1cccc2ccccc12)NC(=O)Cc1cncn1Cc1ccc(OC)cc1

nearest known ligand 0.64

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
FNTA P49354 16/20 0.64
FNTB P49356 16/20 0.64
LCK P06239 3/20 0.39

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
SCHEMBL8763284 0.96 FNTA (0.58) FNTAFNTBLCK
SCHEMBL8865579 0.95 FNTA (0.71) FNTAFNTB
SCHEMBL8763847 0.94 FNTA (0.63) FNTAFNTB
SCHEMBL8763865 0.94 FNTA (0.63) FNTAFNTB
SCHEMBL8763043 0.93 FNTA (0.67) FNTAFNTB
SCHEMBL8866072 0.92 FNTA (0.69) FNTAFNTB
SCHEMBL9060165 0.92 FNTA (0.62) FNTAFNTB
SCHEMBL7516854 0.92 FNTA (0.63) FNTAFNTB
SCHEMBL16792190 0.92 FNTA (0.63) FNTAFNTB
SCHEMBL7516868 0.92 FNTA (0.63) FNTAFNTB

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0783517-A2 THIOL-FREE INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE MERCK & CO. INC. (US) 1997-07-16 EP claimed
WO-1996010034-A2 THIOL-FREE INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE MERCK & CO., INC. (US) 1996-04-04 WO claimed
US-5652257-A ANTICARCINOGENIC MERCK & CO., INC. (US) 1997-07-29 US disclosed
EP-0783517-A2 THIOL-FREE INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE MERCK & CO. INC. (US) 1997-07-16 EP disclosed
WO-1996010034-A2 THIOL-FREE INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE MERCK & CO., INC. (US) 1996-04-04 WO disclosed