SCHEMBL8206498

SCHEMBL8206498

CSCC[C@H](NC(=O)c1ccc(C=C(Cc2ncc[nH]2)c2nccs2)c(-c2ccccc2)c1)C(=O)O

nearest known ligand 0.41

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
FNTA P49354 11/20 0.41
FNTB P49356 11/20 0.41
PGGT1B P53609 1/20 0.40
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38

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
SCHEMBL8207365 0.87 FNTA (0.40) FNTAFNTBPGGT1B
SCHEMBL8199698 0.86 FNTA (0.46) FNTAFNTBPGGT1B
SCHEMBL7706347 0.83 FNTA (0.46) FNTAFNTB
SCHEMBL7706350 0.83 FNTA (0.46) FNTAFNTB
SCHEMBL8206261 0.80 FNTA (0.51) FNTAFNTB
SCHEMBL8199451 0.80 FNTA (0.43) FNTAFNTB
SCHEMBL8206449 0.79 FNTA (0.45) FNTAFNTB
SCHEMBL6623986 0.75 FNTA (0.52) FNTAFNTBPGGT1B
SCHEMBL6623995 0.75 FNTA (0.52) FNTAFNTBPGGT1B
SCHEMBL8207251 0.75 MRGPRX4 (0.38) FNTAFNTBPGGT1BCA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0975603-A1 INHIBITORS OF FARNESYL PROTEIN TRANSFERASE ZENECA LIMITED (GB) 2000-02-02 EP claimed
WO-1998032741-A1 INHIBITORS OF FARNESYL PROTEIN TRANSFERASE ZENECA LIMITED (GB) 1998-07-30 WO claimed
EP-0975603-A1 INHIBITORS OF FARNESYL PROTEIN TRANSFERASE ZENECA LIMITED (GB) 2000-02-02 EP disclosed
WO-1998032741-A1 INHIBITORS OF FARNESYL PROTEIN TRANSFERASE ZENECA LIMITED (GB) 1998-07-30 WO disclosed