SCHEMBL7058035

SCHEMBL7058035

Cc1ccc(NC(=O)c2ccccc2C(=O)Nc2ccc(C)cc2)cc1

nearest known ligand 0.79

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 8/20 0.79
NPC1 O15118 7/20 0.79
SMN1; SMN2 Q16637 4/20 0.79
LMNA P02545 2/20 0.79
TP53 P04637 2/20 0.79
HTT P42858 2/20 0.79
NFKB1 P19838 1/20 0.79
NFKB2 Q00653 1/20 0.79
RELA Q04206 1/20 0.79
HSD17B10 Q99714 1/20 0.79
TDP1 Q9NUW8 3/20 0.72
MAPT P10636 3/20 0.69
PNLIP P16233 1/20 0.66
KMT2A Q03164 5/20 0.65
MEN1 O00255 4/20 0.65
POLB P06746 2/20 0.65
KDM4E B2RXH2 1/20 0.65
HPGD P15428 2/20 0.63
ALDH1A1 P00352 2/20 0.62
AHR P35869 1/20 0.59

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
SCHEMBL10489953 0.93 ALDH1A1 (0.76) RAB9ANPC1SMN1; SMN2LMNATP53
SCHEMBL5742618 0.91 RAB9A (0.68) RAB9ANPC1SMN1; SMN2LMNATP53
SCHEMBL3684485 0.90 HPGD (0.79) RAB9ANPC1SMN1; SMN2LMNATP53
SCHEMBL29519361 0.90 HPGD (0.79) RAB9ANPC1SMN1; SMN2LMNATP53
SCHEMBL5079177 0.89 RAB9A (1.00) RAB9ANPC1SMN1; SMN2LMNATP53
SCHEMBL13475431 0.88 RAB9A (0.64) RAB9ANPC1SMN1; SMN2LMNATP53
SCHEMBL8060238 0.87 NPC1 (0.75) RAB9ANPC1SMN1; SMN2LMNATP53
SCHEMBL1961876 0.87 NPC1 (0.68) RAB9ANPC1SMN1; SMN2LMNATP53
SCHEMBL11590379 0.87 KMT2A (0.74) RAB9ANPC1SMN1; SMN2LMNATP53
SCHEMBL8055108 0.87 SMO (0.71) RAB9ANPC1SMN1; SMN2LMNATP53

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-1263861-B1 RUBBER VULCANIZATES HAVING IMPROVED AGEING PROPERTIES FLEXSYS BV (NL) 2004-01-28 EP disclosed
EP-1263861-A1 RUBBER VULCANIZATES HAVING IMPROVED AGEING PROPERTIES Flexsys B.V. (NL) 2002-12-11 EP disclosed
US-6444759-B2 CONTAINING N,N'-DISUBSTITUTED PHENYLENEDIAMINE COMPOUND FLEXSYS B.V. (NL) 2002-09-03 US disclosed
US-20010031836-A1 Rubber vulcanizates having improved ageing properties FLEXSYS B.V. (NL) 2001-10-18 US disclosed
WO-2001068761-A1 RUBBER VULCANIZATES HAVING IMPROVED AGEING PROPERTIES FLEXSYS B.V. (NL) 2001-09-20 WO disclosed