Butylated Hydroxytoluene

Butylated Hydroxytoluene

SCHEMBL2537031

CCCC(c1cc(C(C)(C)C)c(O)cc1C)c1cc(C(C)(C)C)c(O)cc1C.Cc1cc(C(C)(C)C)c(O)c(C(C)(C)C)c1

nearest known ligand 0.83

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 6/20 0.83
CYP2C19 P33261 6/20 0.83
ALOX15 P16050 5/20 0.83
TP53 P04637 3/20 0.83
CYP2D6 P10635 2/20 0.83
ALDH1A1 P00352 6/20 0.50
SMN1; SMN2 Q16637 4/20 0.50
CA2 P00918 3/20 0.50
POLB P06746 1/20 0.50
TYR P14679 1/20 0.50
HSPA5 P11021 1/20 0.43
HIF1A Q16665 4/20 0.42
HSD17B10 Q99714 1/20 0.41
TSHR P16473 4/20 0.40
CYP3A4 P08684 3/20 0.40
MAPK1 P28482 2/20 0.40
TDP1 Q9NUW8 1/20 0.40
CYP1A2 P05177 4/20 0.38
MAPT P10636 3/20 0.38
KDM4E B2RXH2 2/20 0.38

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
SCHEMBL15738035 0.95 CYP2C9 (0.79) CYP2C9CYP2C19ALOX15TP53CYP2D6
SCHEMBL39107 0.91 CYP2C9 (1.00) CYP2C9CYP2C19ALOX15TP53CYP2D6
SCHEMBL29375990 0.91 CYP2C9 (1.00) CYP2C9CYP2C19ALOX15TP53CYP2D6
SCHEMBL29381967 0.91 CYP2C9 (1.00) CYP2C9CYP2C19ALOX15TP53CYP2D6
SCHEMBL9860200 0.91 CYP2C9 (0.73) CYP2C9CYP2C19ALOX15TP53CYP2D6
SCHEMBL6159030 0.90 CYP2C9 (0.71) CYP2C9CYP2C19ALOX15TP53CYP2D6
SCHEMBL31406588 0.90 CYP2C9 (0.97) CYP2C9CYP2C19ALOX15TP53CYP2D6
SCHEMBL7635287 0.90 CYP2C9 (0.97) CYP2C9CYP2C19ALOX15TP53CYP2D6
SCHEMBL11459104 0.89 ALOX15 (0.79) CYP2C9CYP2C19ALOX15TP53CYP2D6
SCHEMBL14432385 0.87 ALOX15 (0.91) CYP2C9CYP2C19ALOX15TP53CYP2D6

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-2236560-B1 POLYARYLENE SULFIDE RESIN COMPOSITION, PRODUCTION METHOD THEREOF AND SURFACE MOUNT ELECTRONIC COMPONENT DAINIPPON INK & CHEMICALS (JP) 2017-03-01 EP disclosed
US-8044126-B2 Polyarylene sulfide resin composition, production method thereof and surface mount electronic component DIC CORPORATION (JP) 2011-10-25 US disclosed
US-20100331463-A1 POLYARYLENE SULFIDE RESIN COMPOSITION, PRODUCTION METHOD THEREOF AND SURFACE MOUNT ELECTRONIC COMPONENT DIC CORPORATION (JP) 2010-12-30 US disclosed
EP-2236560-A1 POLY(ARYLENE SULFIDE) RESIN COMPOSITION, PROCESS FOR PRODUCTION THEREOF, AND SURFACE MOUNT ELECTRONIC COMPONENT DIC Corporation (JP) 2010-10-06 EP disclosed
EP-0374813-B1 Magnetic recording medium BASF AG (DE) 1996-07-24 EP disclosed