SCHEMBL18257136

SCHEMBL18257136

COc1cc(C(C)c2ccccc2)c(C(C)c2ccccc2)c(C(C)c2ccccc2)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TYR P14679 1/20 0.43
▸ ALDH1A1 P00352 3/20 0.42
▸ CA4 P22748 1/20 0.41
▸ CASR P41180 1/20 0.40
▸ CYP3A4 P08684 2/20 0.39
▸ MEN1 O00255 2/20 0.39
▸ KMT2A Q03164 2/20 0.39
▸ KDM4E B2RXH2 1/20 0.39
▸ USP2 O75604 1/20 0.39
▸ TP53 P04637 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ HPGD P15428 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ TRPV1 Q8NER1 1/20 0.39
▸ HSD17B10 Q99714 1/20 0.39
▸ ACP3 P15309 1/20 0.39
▸ CYP1A2 P05177 1/20 0.38
▸ CYP2D6 P10635 1/20 0.38
▸ CYP2C9 P11712 1/20 0.38
▸ ALOX15 P16050 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
SCHEMBL22708266 0.84 CASR (0.40) TYRALDH1A1CA4CASRCYP3A4
SCHEMBL22708475 0.84 TYR (0.42) TYRALDH1A1CA4CASRCYP3A4
SCHEMBL22708265 0.84 TYR (0.42) TYRALDH1A1CA4CASRCYP3A4
SCHEMBL18254173 0.84 TYR (0.42) TYRALDH1A1CYP3A4MEN1KMT2A
SCHEMBL20457351 0.82 RELA (0.43) TYRALDH1A1CYP3A4MEN1KMT2A
SCHEMBL18254174 0.80 BRD4 (0.40) TYRALDH1A1CYP3A4MEN1KMT2A
SCHEMBL4670011 0.79 CYP2D6 (0.56) ALDH1A1MEN1KMT2AHSD17B10CYP2D6
SCHEMBL22708260 0.78 TYR (0.38) TYRALDH1A1CA4CASRCYP3A4
SCHEMBL22708263 0.78 KMT2A (0.42) TYRALDH1A1CASRMEN1KMT2A
SCHEMBL223314 0.77 TYR (0.51) TYRALDH1A1CYP3A4MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10040964-B2 Use of tristyrylphenol alkoxylate sulfosuccinates in emulsion polymerization and coatings STEPAN COMPANY (US) 2018-08-07 — — US disclosed
US-20160340526-A1 Use of Tristyrylphenol Alkoxylate Sulfosuccinates in Emulsion Polymerization and Coatings STEPAN COMPANY 2016-11-24 — — US disclosed
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