SCHEMBL10694070

SCHEMBL10694070

Cc1cc(SC(Sc2cc(C)c(O)c(C(C)(C)C)c2)Sc2cc(C)c(O)c(C(C)(C)C)c2)cc(C(C)(C)C)c1O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 4/20 0.55
CYP2C19 P33261 4/20 0.55
CYP1A2 P05177 3/20 0.55
ALOX15 P16050 3/20 0.50
MAPT P10636 2/20 0.50
HPN P05981 1/20 0.50
SIRT5 Q9NXA8 1/20 0.50
SMN1; SMN2 Q16637 6/20 0.45
CA2 P00918 3/20 0.45
ALDH1A1 P00352 3/20 0.45
POLB P06746 1/20 0.45
TYR P14679 1/20 0.45
CA1 P00915 2/20 0.42
GABRA1 P14867 1/20 0.41
GABRB2 P47870 1/20 0.41
PTGS1 P23219 2/20 0.39
HIF1A Q16665 4/20 0.38
TP53 P04637 2/20 0.38
MEN1 O00255 1/20 0.38
GALR3 O60755 1/20 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
SCHEMBL10706853 0.91 CYP2C9 (0.53) CYP2C9CYP2C19CYP1A2ALOX15MAPT
SCHEMBL10698130 0.88 ALOX15 (0.63) CYP2C9CYP2C19CYP1A2ALOX15MAPT
SCHEMBL10507688 0.85 CYP2C9 (0.47) CYP2C9CYP2C19CYP1A2ALOX15MAPT
SCHEMBL10505856 0.82 CYP2C9 (0.45) CYP2C9CYP2C19CYP1A2ALOX15MAPT
SCHEMBL27236 0.82 CYP2C9 (0.61) CYP2C9CYP2C19CYP1A2ALOX15MAPT
SCHEMBL29362395 0.82 CYP2C9 (0.61) CYP2C9CYP2C19CYP1A2ALOX15MAPT
SCHEMBL4595518 0.82 CYP2C9 (0.61) CYP2C9CYP2C19CYP1A2ALOX15MAPT
SCHEMBL10696728 0.82 CA1 (0.48) CYP2C9CYP1A2MAPTCA2ALDH1A1
SCHEMBL10846855 0.80 CYP2C9 (0.42) CYP2C9CYP2C19CYP1A2ALOX15MAPT
SCHEMBL4811810 0.79 CYP2C9 (0.57) CYP2C9CYP2C19CYP1A2ALOX15MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0255478-A1 Tris(substituted hydroxyphenyl-thio)trithioorthoesters CIBA-GEIGY AG (CH) 1988-02-03 EP claimed
US-4659762-A Tris (substituted hydroxyphenylthio) trithioorthoester stabilizers for polymers CIBA-GEIGY CORPORATION (US) 1987-04-21 US claimed
EP-0255478-A1 Tris(substituted hydroxyphenyl-thio)trithioorthoesters CIBA-GEIGY AG (CH) 1988-02-03 EP disclosed
US-4659762-A Tris (substituted hydroxyphenylthio) trithioorthoester stabilizers for polymers CIBA-GEIGY CORPORATION (US) 1987-04-21 US disclosed