SCHEMBL7657854

SCHEMBL7657854

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

nearest known ligand 0.49

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
FNTA P49354 7/20 0.49
FNTB P49356 7/20 0.49
PGGT1B P53609 2/20 0.42
CYP51A1 Q16850 1/20 0.38
ALDH1A1 P00352 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
CYP24A1 Q07973 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
SCHEMBL7658747 0.87 FNTA (0.46) FNTAFNTBCYP51A1ALDH1A1
SCHEMBL7668699 0.87 FNTA (0.51) FNTAFNTBPGGT1BALDH1A1NPSR1
SCHEMBL7657859 0.87 FNTA (0.51) FNTAFNTBPGGT1BALDH1A1NPSR1
SCHEMBL7657870 0.85 FNTA (0.53) FNTAFNTBPGGT1BALDH1A1NPSR1
SCHEMBL7562597 0.85 FNTA (0.49) FNTAFNTBPGGT1BALDH1A1
SCHEMBL7564412 0.85 FNTA (0.49) FNTAFNTBPGGT1B
SCHEMBL7609223 0.83 FNTA (0.52) FNTAFNTBPGGT1BALDH1A1NPSR1
SCHEMBL7708788 0.82 FNTA (0.49) FNTAFNTBPGGT1BALDH1A1NPSR1
SCHEMBL7708783 0.82 FNTA (0.49) FNTAFNTBPGGT1BALDH1A1NPSR1
SCHEMBL7671901 0.81 FNTA (0.51) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6410539-B1 ANTICARCINOGENIC AGENTS ASTRAZENCA UK LIMITED (GB) 2002-06-25 US claimed
EP-1025089-A1 IMIDAZOLE DERIVATIVES AND THEIR USE AS FARNESYL PROTEIN TRANSFERASE INHIBITORS ZENECA LIMITED (GB) 2000-08-09 EP claimed
WO-1999020612-A1 IMIDAZOLE DERIVATIVES AND THEIR USE AS FARNESYL PROTEIN TRANSFERASE INHIBITORS ASTRAZENECA UK LIMITED (GB) 1999-04-29 WO claimed
US-6410539-B1 ANTICARCINOGENIC AGENTS ASTRAZENCA UK LIMITED (GB) 2002-06-25 US disclosed