SCHEMBL7870262

SCHEMBL7870262

COC(=O)[C@H](CCSC)NC(=O)c1ccc(CN(C)CCC2CCCCC2)cc1-c1ccccc1

nearest known ligand 0.70

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
FNTA P49354 4/20 0.59
FNTB P49356 4/20 0.59
TDP1 Q9NUW8 1/20 0.51

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
SCHEMBL629359 0.93 FNTA (0.68) FNTAFNTB
SCHEMBL629358 0.93 FNTA (0.68) FNTAFNTB
SCHEMBL6625746 0.92 FNTA (0.69) FNTAFNTB
SCHEMBL629061 0.85 FNTA (0.80) FNTAFNTB
SCHEMBL629100 0.85 FNTA (0.80) FNTAFNTB
SCHEMBL628793 0.84 FNTA (0.79) FNTAFNTB
SCHEMBL628794 0.84 FNTA (0.79) FNTAFNTB
SCHEMBL10192967 0.83 FNTA (0.74) FNTAFNTB
SCHEMBL629882 0.82 FNTA (0.67) FNTAFNTB
Lithium Ion SCHEMBL628792 0.82 FNTA (0.69) 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