SCHEMBL7862459

SCHEMBL7862459

COC(=O)c1ccc(CN(CCCC2CCCCC2)S(=O)(=O)c2ccccc2)cc1-c1ccccc1C

nearest known ligand 0.48

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
FNTA P49354 1/20 0.48
FNTB P49356 1/20 0.48
TAS2R14 Q9NYV8 3/20 0.42
PTGES O14684 2/20 0.42
MMP3 P08254 1/20 0.41
STAT3 P40763 2/20 0.40
CXCR3 P49682 1/20 0.39

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
SCHEMBL7869174 0.92 MMP3 (0.45) FNTAFNTBTAS2R14PTGESMMP3
SCHEMBL7862519 0.90 MMP3 (0.54) FNTAFNTBTAS2R14PTGESMMP3
SCHEMBL7862520 0.90 MMP3 (0.46) FNTAFNTBTAS2R14PTGESMMP3
SCHEMBL7862462 0.89 FNTA (0.44) FNTAFNTBTAS2R14PTGESMMP3
SCHEMBL7869003 0.88 MAPK1 (0.44) FNTAFNTBMMP3STAT3
SCHEMBL10193322 0.87 FNTA (0.49) FNTAFNTB
SCHEMBL628907 0.84 FNTA (0.49) FNTAFNTBMMP3
SCHEMBL7874245 0.83 STAT3 (0.48) FNTAFNTBTAS2R14PTGESSTAT3
SCHEMBL10192973 0.83 FNTA (0.47) FNTAFNTBMMP3
SCHEMBL6629601 0.83 FNTA (0.65) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6310095-B1 INHIBITING OR TREATING CANCER, TREATING INTIMAL HYPERPLASIA ASSOCIATED WITH RESTENOSIS AND ATHEROSCLEROSIS, INHIBITING POST-TRANSLATIONAL MODIFICATION OF ONCOGENIC RAS PROTEIN BY PROTEIN FARNESYLTRANSFERASE AND/OR GERANYLGERANYLTRANSFERASE UNIVERSITY OF PITTSBURGH 2001-10-30 US disclosed