SCHEMBL7871302

SCHEMBL7871302

Cc1ccccc1-c1cc(CN(CCC2CCCCC2)S(=O)(=O)c2ccc(Br)cc2)ccc1C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
FNTA P49354 1/20 0.46
FNTB P49356 1/20 0.46
PTGES O14684 2/20 0.44
TAS2R14 Q9NYV8 2/20 0.43
MEN1 O00255 1/20 0.43
HTT P42858 1/20 0.43
KMT2A Q03164 1/20 0.43
STAT3 P40763 7/20 0.42
MMP3 P08254 1/20 0.42
TP53 P04637 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
SCHEMBL7874245 0.93 STAT3 (0.48) FNTAFNTBPTGESTAS2R14STAT3
SCHEMBL7862520 0.91 MMP3 (0.46) FNTAFNTBPTGESTAS2R14MEN1
SCHEMBL7862505 0.89 STAT3 (0.48) FNTAFNTBPTGESKMT2ASTAT3
SCHEMBL7862401 0.89 FNTA (0.46) FNTAFNTBPTGESTAS2R14STAT3
SCHEMBL6624385 0.84 FNTA (0.69) FNTAFNTB
SCHEMBL7869174 0.84 MMP3 (0.45) FNTAFNTBPTGESTAS2R14STAT3
SCHEMBL7869137 0.83 FNTA (0.51) FNTAFNTB
SCHEMBL7862519 0.83 MMP3 (0.54) FNTAFNTBPTGESTAS2R14MMP3
SCHEMBL7862459 0.82 FNTA (0.48) FNTAFNTBPTGESTAS2R14STAT3
SCHEMBL6623598 0.82 FNTA (0.60) 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