SCHEMBL629682

SCHEMBL629682

CCCCN(CCC1CCCCC1)Cc1ccc(C(=O)O)c(-c2ccccc2C)c1

nearest known ligand 0.69

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
FNTA P49354 1/20 0.69
FNTB P49356 1/20 0.69
BCHE P06276 12/20 0.52
ACHE P22303 3/20 0.50
LTB4R2 Q9NPC1 1/20 0.44

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
SCHEMBL10192961 0.90 FNTA (0.67) FNTAFNTBBCHEACHE
SCHEMBL6624997 0.85 FNTA (0.52) FNTAFNTBBCHEACHE
SCHEMBL628888 0.83 FNTA (0.51) FNTAFNTBLTB4R2
SCHEMBL7869070 0.83 BCHE (0.50) FNTAFNTBBCHELTB4R2
SCHEMBL10192976 0.83 FNTA (0.51) FNTAFNTBLTB4R2
SCHEMBL629301 0.83 FNTA (1.00) FNTAFNTB
SCHEMBL629302 0.83 FNTA (1.00) FNTAFNTB
SCHEMBL7869137 0.83 FNTA (0.51) FNTAFNTBLTB4R2
SCHEMBL10193047 0.83 FNTA (0.54) FNTAFNTB
SCHEMBL628947 0.80 FNTA (0.87) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0986384-B1 INHIBITORS OF PROTEIN ISOPRENYL TRANSFERASES UNIV PITTSBURGH (US) 2012-02-22 EP disclosed
EP-0986384-B1 INHIBITORS OF PROTEIN ISOPRENYL TRANSFERASES UNIV PITTSBURGH (US) 2012-02-22 EP disclosed
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