SCHEMBL7897668

SCHEMBL7897668

COC(=O)C(CCS(C)(=O)=O)NC(=O)c1ccc(OCc2ccccc2)cc1-c1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FNTA P49354 3/20 0.44
FNTB P49356 3/20 0.44
TDP1 Q9NUW8 1/20 0.44
PPARG P37231 2/20 0.43
KCNA3 P22001 1/20 0.42
BCL2L1 Q07817 1/20 0.42
MAOB P27338 1/20 0.42
ERAP2 Q6P179 1/20 0.42
LNPEP Q9UIQ6 1/20 0.42
MAOA P21397 1/20 0.42
PGGT1B P53609 2/20 0.42
GPR132 Q9UNW8 1/20 0.41
GAA P10253 1/20 0.41
RAB9A P51151 1/20 0.41
PTPN1 P18031 1/20 0.41

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
SCHEMBL7907270 0.92 FNTA (0.41) FNTAFNTBTDP1PGGT1BGAA
SCHEMBL7910059 0.85 FNTA (0.60) FNTAFNTBTDP1
SCHEMBL7910060 0.85 FNTA (0.60) FNTAFNTBTDP1
SCHEMBL7897673 0.80 ALDH1A1 (0.43) FNTAFNTBPPARGKCNA3BCL2L1
SCHEMBL7904342 0.78 FNTA (0.39) FNTAFNTBTDP1PGGT1B
SCHEMBL6777951 0.78 FNTA (0.60) FNTAFNTB
SCHEMBL6777949 0.78 FNTA (0.60) FNTAFNTB
SCHEMBL6641648 0.76 FNTA (0.52) FNTAFNTB
SCHEMBL4460274 0.75 MAOB (0.57) PPARGMAOBMAOARAB9A
SCHEMBL6776059 0.75 PDE4B (0.44)

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-6204293-B1 INHIBITING POST-TRANSLATIONAL MODIFICATION OF THE ONCOGENIC RAS PROTEIN BY PROTEIN FARNESYLTRANSFERASE, PROTEIN GERANYLGERANYLTRANSFERASE, OR BOTH UNIVERSITY OF PITTSBURGH 2001-03-20 US disclosed