SCHEMBL628800

SCHEMBL628800

COC(=O)c1ccc(CN(C)CCC2C=CCCC2)cc1-c1ccccc1C

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
FNTA P49354 1/20 0.37
FNTB P49356 1/20 0.37
KMT2A Q03164 3/20 0.36
MEN1 O00255 2/20 0.36
LMNA P02545 1/20 0.36
ATM Q13315 1/20 0.35
TACR1 P25103 1/20 0.34
HDAC11 Q96DB2 1/20 0.33
HTR7 P34969 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL628443 0.90 FNTA (0.39) FNTAFNTBKMT2AMEN1ATM
SCHEMBL630025 0.82 FNTA (0.54) FNTAFNTB
SCHEMBL628432 0.80 FNTA (0.62) FNTAFNTB
SCHEMBL628802 0.80 FNTA (0.36) FNTAFNTBKMT2AMEN1
SCHEMBL628801 0.77 L3MBTL1 (0.41) KMT2AMEN1LMNAATMSMN1; SMN2
SCHEMBL629790 0.75 FNTA (0.40) FNTAFNTBKMT2AMEN1LMNA
SCHEMBL630166 0.73 FNTA (0.49) FNTAFNTB
SCHEMBL6624997 0.73 FNTA (0.52) FNTAFNTB
SCHEMBL6625435 0.72 BCHE (0.43) FNTAFNTBKMT2AMEN1LMNA
SCHEMBL10192961 0.71 FNTA (0.67) 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 5 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-A4 INHIBITORS OF PROTEIN ISOPRENYL TRANSFERASES UNIV PITTSBURGH (US) 2004-09-15 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
EP-0986384-A1 INHIBITORS OF PROTEIN ISOPRENYL TRANSFERASES UNIVERSITY OF PITTSBURGH (US) 2000-03-22 EP disclosed
WO-1998050029-A1 INHIBITORS OF PROTEIN ISOPRENYL TRANSFERASES UNIVERSITY OF PITTSBURGH (US) 1998-11-12 WO disclosed