SCHEMBL8077351

SCHEMBL8077351

CCc1cc(Cc2cc(O)c(C(C)(C)C)cc2CC)c(O)c(C(C)(C)C)c1

nearest known ligand 0.79

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSPA5 P11021 2/20 0.79
HIF1A Q16665 4/20 0.49
CYP2C9 P11712 3/20 0.49
CYP2C19 P33261 3/20 0.49
SMN1; SMN2 Q16637 3/20 0.49
CYP2D6 P10635 2/20 0.44
HSD17B10 Q99714 1/20 0.44
ALDH1A1 P00352 6/20 0.41
MAPT P10636 5/20 0.41
CYP1A2 P05177 3/20 0.41
ALOX15 P16050 3/20 0.41
KDM4E B2RXH2 3/20 0.41
ATP2A2 P16615 1/20 0.41
ATP2A3 Q93084 1/20 0.41
KMT2A Q03164 4/20 0.40
TSHR P16473 3/20 0.40
MAPK1 P28482 3/20 0.40
MEN1 O00255 3/20 0.40
CYP3A4 P08684 2/20 0.40
BLM P54132 2/20 0.40

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
SCHEMBL2777970 0.92 HSPA5 (0.87) HSPA5HIF1ACYP2C9CYP2C19SMN1; SMN2
SCHEMBL30599778 0.89 HSPA5 (1.00) HSPA5HIF1ACYP2C9CYP2C19SMN1; SMN2
SCHEMBL27533 0.89 HSPA5 (1.00) HSPA5HIF1ACYP2C9CYP2C19SMN1; SMN2
SCHEMBL9475586 0.87 HSPA5 (0.96) HSPA5HIF1ACYP2C9CYP2C19SMN1; SMN2
Phosphoric Acid SCHEMBL28676743 0.84 HSPA5 (0.84) HSPA5HIF1ACYP2C9CYP2C19SMN1; SMN2
SCHEMBL14089294 0.84 HSPA5 (0.83) HSPA5HIF1ACYP2C9CYP2C19SMN1; SMN2
SCHEMBL57329 0.84 HSPA5 (0.82) HSPA5HIF1ACYP2C9CYP2C19SMN1; SMN2
Phosphoric Acid SCHEMBL28673418 0.82 HSPA5 (0.79) HSPA5HIF1ACYP2C9CYP2C19SMN1; SMN2
SCHEMBL16281206 0.82 HSPA5 (0.79) HSPA5HIF1ACYP2C9CYP2C19SMN1; SMN2
SCHEMBL14606508 0.81 HSPA5 (0.84) HSPA5HIF1ACYP2C9CYP2C19SMN1; SMN2

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-0686172-B1 STABILIZED POLYETHER POLYOL AND POLYURETHANE FOAM OBTAINED THEREFROM UNIROYAL CHEM CO INC (US) 2000-11-08 EP disclosed
EP-0686172-A1 STABILIZED POLYETHER POLYOL AND POLYURETHANE FOAM OBTAINED THEREFROM UNIROYAL CHEMICAL COMPANY, Inc. (US) 1995-12-13 EP disclosed
WO-1994019404-A1 STABILIZED POLYETHER POLYOL AND POLYURETHANE FOAM OBTAINED THEREFROM UNIROYAL CHEMICAL COMPANY, INC. (US) 1994-09-01 WO disclosed
US-5308884-A Mixture of dimethylbenzyl substituted diphenylamines, improved scorch resistance, hydrolytic and color stability UNIROYAL CHEMICAL COMPANY, INC. (US) 1994-05-03 US disclosed
US-4178282-A ALKALI OR ALKALINE EARTH METAL SOAPS OR PHENOLATES OR ZINC HALIDES IN ALCOHOLS OR ORGANOPHOSPHITES CLAREMONT POLYCHEMICAL CORPORATION (US) 1979-12-11 US disclosed