SCHEMBL9409972

SCHEMBL9409972

CC(C)[C@H](NC(=O)[C@@H](N)CS)C(=O)N1Cc2ccccc2CC1C(=O)N[C@H](Cc1ccccc1)C(=O)O

nearest known ligand 0.60

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
FNTA P49354 4/20 0.60
FNTB P49356 4/20 0.60
OPRD1 P41143 3/20 0.58
PGGT1B P53609 1/20 0.54
AGTR1 P30556 2/20 0.51
AGTR2 P50052 2/20 0.51
SLC6A2 P23975 1/20 0.49

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
SCHEMBL9409964 1.00 FNTA (0.60) FNTAFNTBOPRD1PGGT1BAGTR1
SCHEMBL9409955 1.00 FNTA (0.60) FNTAFNTBOPRD1PGGT1BAGTR1
SCHEMBL9409859 0.92 FNTA (0.62) FNTAFNTBOPRD1PGGT1BAGTR1
SCHEMBL9409884 0.92 FNTA (0.62) FNTAFNTBOPRD1PGGT1BAGTR1
SCHEMBL9409873 0.92 FNTA (0.62) FNTAFNTBOPRD1PGGT1BAGTR1
SCHEMBL9410018 0.91 FNTA (0.62) FNTAFNTBOPRD1PGGT1B
SCHEMBL9409945 0.91 FNTA (0.62) FNTAFNTBOPRD1PGGT1B
SCHEMBL9409937 0.91 FNTA (0.62) FNTAFNTBOPRD1PGGT1B
SCHEMBL9409895 0.89 FNTA (0.56) FNTAFNTBOPRD1PGGT1BAGTR1
SCHEMBL9409885 0.89 FNTA (0.56) FNTAFNTBOPRD1PGGT1BAGTR1

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
EP-0618221-A2 Heterocyclic inhibitors of farnesyl protein transferase BRISTOL-MYERS SQUIBB COMPANY (US) 1994-10-05 EP disclosed