SCHEMBL8209847

SCHEMBL8209847

CSCC[C@H](NC(=O)c1cc(C=C(Cc2ncc[nH]2)c2ccc(F)cc2)ccc1CCc1ccc(F)cc1)C(=O)O

nearest known ligand 0.41

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
FNTA P49354 12/20 0.41
FNTB P49356 12/20 0.41
PGGT1B P53609 1/20 0.41
ALDH1A1 P00352 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36

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
SCHEMBL8205732 0.91 FNTA (0.37) FNTAFNTBPGGT1BALDH1A1
SCHEMBL8205624 0.86 CA2 (0.46) FNTAFNTBPGGT1BALDH1A1NPSR1
SCHEMBL8207254 0.86 FNTA (0.47) FNTAFNTB
SCHEMBL8199776 0.85 FNTA (0.49) FNTAFNTB
SCHEMBL8206389 0.84 FNTA (0.46) FNTAFNTBPGGT1BALDH1A1
SCHEMBL8198280 0.84 FNTA (0.46) FNTAFNTBPGGT1BALDH1A1
SCHEMBL8204858 0.83 GAA (0.36) ALDH1A1
SCHEMBL8199385 0.83 FNTA (0.52) FNTAFNTB
SCHEMBL7708783 0.83 FNTA (0.49) FNTAFNTBPGGT1BALDH1A1NPSR1
SCHEMBL7708788 0.83 FNTA (0.49) FNTAFNTBPGGT1BALDH1A1NPSR1

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 6 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-1054865-A1 FARNESYL TRANSFERASE INHIBITORS AstraZeneca UK Limited (GB) 2000-11-29 EP disclosed
EP-0975603-A1 INHIBITORS OF FARNESYL PROTEIN TRANSFERASE ZENECA LIMITED (GB) 2000-02-02 EP disclosed
WO-1999041235-A1 FARNESYL TRANSFERASE INHIBITORS ASTRAZENECA UK LIMITED (GB) 1999-08-19 WO disclosed
WO-1998032741-A1 INHIBITORS OF FARNESYL PROTEIN TRANSFERASE ZENECA LIMITED (GB) 1998-07-30 WO disclosed