SCHEMBL7904342

SCHEMBL7904342

CC(=O)N(OCc1ccccc1)Oc1ccc(C(=O)NC(CCS(C)(=O)=O)C(=O)O)c(-c2ccccc2)c1

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
FNTA P49354 3/20 0.39
FNTB P49356 3/20 0.39
PGGT1B P53609 2/20 0.39
KMT2A Q03164 2/20 0.37
TDP1 Q9NUW8 1/20 0.37
MEN1 O00255 1/20 0.37
KDM4E B2RXH2 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2C19 P33261 1/20 0.36
HSD17B10 Q99714 1/20 0.36

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
SCHEMBL7906736 0.86 FNTA (0.43) FNTAFNTBPGGT1BTDP1
SCHEMBL7897668 0.78 FNTA (0.44) FNTAFNTBPGGT1BTDP1
SCHEMBL7907270 0.75 FNTA (0.41) FNTAFNTBPGGT1BKMT2ATDP1
SCHEMBL6775734 0.69 FNTA (0.44) FNTAFNTB
SCHEMBL6777582 0.68 FNTA (0.48) FNTAFNTB
SCHEMBL6778550 0.67 FNTA (0.64) FNTAFNTB
SCHEMBL7897673 0.67 ALDH1A1 (0.43) FNTAFNTBPGGT1BKMT2AMEN1
SCHEMBL7905106 0.66 FNTA (0.64) FNTAFNTBPGGT1BTDP1
SCHEMBL7905102 0.66 FNTA (0.64) FNTAFNTBPGGT1BTDP1
SCHEMBL8194280 0.65 FNTA (0.40) FNTAFNTBPGGT1B

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1998050031-A1 INHIBITORS OF PROTEIN ISOPRENYL TRANSFERASES UNIVERSITY OF PITTSBURGH (US) 1998-11-12 WO claimed
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