SCHEMBL5873128

SCHEMBL5873128

Cc1cc(CSCC(O)CO)c(O)c(CSCC(O)CO)c1

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 3/20 0.39
CYP2C19 P33261 2/20 0.39
HIF1A Q16665 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
BCHE P06276 1/20 0.37
AMY1A P0DUB6 1/20 0.36
HSPA5 P11021 1/20 0.36
CYP1A2 P05177 1/20 0.33
CYP2D6 P10635 1/20 0.32
HSD17B10 Q99714 1/20 0.32
APEX1 P27695 1/20 0.31
ALDH1A1 P00352 1/20 0.31
CA2 P00918 1/20 0.31
POLB P06746 1/20 0.31
TYR P14679 1/20 0.31
SELL P14151 1/20 0.30
SELP P16109 1/20 0.30
SELE P16581 1/20 0.30
VCAM1 P19320 1/20 0.30

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
SCHEMBL10691072 0.84 CYP2D6 (0.37) CYP2C9CYP2C19CYP1A2CYP2D6
SCHEMBL10704050 0.78 CYP1A2 (0.45) CYP2C9CYP2C19CYP1A2CYP2D6
SCHEMBL1274583 0.76
SCHEMBL1275420 0.75 HSPA5 (0.45) CYP2C9CYP2C19HIF1ASMN1; SMN2HSPA5
SCHEMBL5873009 0.74 CYP2C9 (0.56) CYP2C9CYP2C19HIF1ASMN1; SMN2BCHE
SCHEMBL8990183 0.74 AMY1A (0.42) CYP2C9CYP2C19HIF1ASMN1; SMN2BCHE
SCHEMBL23120116 0.72 CYP1A2 (0.37) CYP2C9CYP2C19SMN1; SMN2CYP1A2CYP2D6
SCHEMBL29594381 0.72 CYP1A2 (0.37) CYP2C9CYP2C19SMN1; SMN2CYP1A2CYP2D6
SCHEMBL13870187 0.71 CYP2D6 (0.49) CYP2C19CYP1A2CYP2D6ALDH1A1
SCHEMBL27511420 0.71 CYP1A2 (0.33) CYP2C19CYP1A2CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7056967-B2 Stabilized medium and high voltage cable insulation composition CIBA SPECIALTY CHEMICALS CORPORATION (US) 2006-06-06 US disclosed
EP-1326915-B1 POLYOLEFIN ARTICLES WITH LONG-TERM ELEVATED TEMPERATURE STABILITY CLARIANT FINANCE BVI LTD (VG) 2005-11-09 EP disclosed
US-6774170-B2 HEAT STABILIZING WITH AN OXIDIZED, NON-CATIONIZED, NON-SILYLATED SULFUR BLACK PIGMENT, A HINDERED PHENOLIC ANTIOXIDANT A SULFUR-CONTAINING SECONDARY STABILIZER, AND A HINDERED AMINE CLARIANT FINANCE (BVI) LIMITED (VG) 2004-08-10 US disclosed
EP-1326915-A2 POLYOLEFIN ARTICLES WITH LONG-TERM ELEVATED TEMPERATURE STABILITY Clariant Finance (BVI) Limited (VG) 2003-07-16 EP disclosed
US-6538056-B1 Polyethylene or polypropylene compounded with sulfur black pigment; sterically hindered phenolic antioxidant and sulfur compound stabilizer; heat resistance CLARIANT INTERNATIONAL LTD. (CH) 2003-03-25 US disclosed
US-20020198344-A1 Stabilized medium and high voltage cable insulation composition CIBA SPECIALTY CHEMICALS CORP. 2002-12-26 US disclosed
US-20020156165-A1 Polyolefin articles with long-term elevated temperature stability CLARIANT INTERNATIONAL LTD. 2002-10-24 US disclosed
EP-1249845-A2 Stabilized medium and high voltage cable insulation composition Ciba SC Holding AG (CH) 2002-10-16 EP disclosed
WO-2002031043-A2 POLYOLEFIN ARTICLES WITH LONG-TERM ELEVATED TEMPERATURE STABILITY CLARIANT FINANCE (BVI) LIMITED (VG) 2002-04-18 WO disclosed
US-5427701-A Heat and oxidation resistance, photostability CIBA-GEIGY CORPORATION (US) 1995-06-27 US disclosed
US-5376290-A For elastomers; heat and oxidation resistance, photostability CIBA-GEIGY CORPORATION (US) 1994-12-27 US disclosed
US-5008459-A For elastomers; registance to heat aging CIBA-GEIGY CORPORATION (US) 1991-04-16 US disclosed
EP-0273013-A1 Substituted phenols as stabilizers CIBA-GEIGY AG (CH) 1988-06-29 EP disclosed