SCHEMBL8209147

SCHEMBL8209147

CSCC[C@H](NC(=O)c1cccc(C=C(Cc2ncc[nH]2)c2ccc(F)cc2)c1)C(N)=O

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FNTA P49354 10/20 0.40
FNTB P49356 10/20 0.40
CA12 O43570 1/20 0.40
CA9 Q16790 1/20 0.40
PGGT1B P53609 3/20 0.39
RAB9A P51151 1/20 0.38
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
KMT2A Q03164 2/20 0.37
MEN1 O00255 1/20 0.36
NAMPT P43490 1/20 0.36
F10 P00742 2/20 0.36
PRSS1 P07477 2/20 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
SCHEMBL8198280 0.94 FNTA (0.46) FNTAFNTBPGGT1BCA1CA2
SCHEMBL8206389 0.94 FNTA (0.46) FNTAFNTBPGGT1BCA1CA2
SCHEMBL8250464 0.88 NAMPT (0.34) FNTAFNTBCA12CA9PGGT1B
SCHEMBL8211056 0.86 FNTA (0.40) FNTAFNTBPGGT1BNAMPT
SCHEMBL8198655 0.86 FNTA (0.41) FNTAFNTB
SCHEMBL8209175 0.85 CA2 (0.41) CA1CA2NAMPT
SCHEMBL8205624 0.84 CA2 (0.46) FNTAFNTBCA12CA9PGGT1B
SCHEMBL8205467 0.82 NAMPT (0.40) NAMPT
SCHEMBL8205943 0.82 ERAP2 (0.40) CA12CA9CA1CA2NAMPT
SCHEMBL8205809 0.82 FNTA (0.46) 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