SCHEMBL7708783

SCHEMBL7708783

CSCC[C@H](NC(=O)c1cc(/C=C(/Cn2ccnc2)c2ccc(F)cc2)ccc1CCc1ccc(F)cc1)C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
FNTA P49354 13/20 0.49
FNTB P49356 13/20 0.49
PGGT1B P53609 1/20 0.41
ALDH1A1 P00352 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37

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
SCHEMBL7708788 1.00 FNTA (0.49) FNTAFNTBPGGT1BALDH1A1NPSR1
SCHEMBL7671901 0.87 FNTA (0.51) FNTAFNTBPGGT1BALDH1A1NPSR1
SCHEMBL7672400 0.87 FNTA (0.51) FNTAFNTBPGGT1BALDH1A1NPSR1
SCHEMBL7671904 0.87 FNTA (0.51) FNTAFNTBPGGT1BALDH1A1NPSR1
SCHEMBL8617653 0.86 FNTA (0.45) FNTAFNTBALDH1A1NPSR1
SCHEMBL7703375 0.86 FNTA (0.45) FNTAFNTBALDH1A1NPSR1
SCHEMBL8617640 0.86 FNTA (0.45) FNTAFNTBALDH1A1NPSR1
SCHEMBL7703378 0.86 FNTA (0.45) FNTAFNTBALDH1A1NPSR1
SCHEMBL7703301 0.86 FNTA (0.52) FNTAFNTB
SCHEMBL7703293 0.86 FNTA (0.52) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6414145-B1 TREATING CANCER AND NEUROFIBROMATOSIS ZENECA LIMITED (GB) 2002-07-02 US claimed
US-6414145-B1 TREATING CANCER AND NEUROFIBROMATOSIS ZENECA LIMITED (GB) 2002-07-02 US disclosed
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