SCHEMBL8070387

SCHEMBL8070387

CCc1cc(Cc2cc(CC)cc(C(C)(C)C)c2O)c(O)c(C(C)(C)C)c1.Cc1cc(Cc2cc(C)cc(C(C)(C)C)c2O)c(O)c(C(C)(C)C)c1

nearest known ligand 0.84

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSPA5 P11021 2/20 0.84
HIF1A Q16665 5/20 0.75
CYP2C9 P11712 5/20 0.75
CYP2C19 P33261 5/20 0.75
SMN1; SMN2 Q16637 4/20 0.75
CYP2D6 P10635 2/20 0.67
HSD17B10 Q99714 1/20 0.67
ALDH1A1 P00352 7/20 0.53
CA2 P00918 2/20 0.53
POLB P06746 1/20 0.53
TYR P14679 1/20 0.53
TSHR P16473 3/20 0.41
LMNA P02545 2/20 0.41
AMY1A P0DUB6 1/20 0.41
GAA P10253 1/20 0.41
MAPK1 P28482 3/20 0.40
CYP1A2 P05177 3/20 0.40
MEN1 O00255 2/20 0.40
TP53 P04637 2/20 0.40
CYP3A4 P08684 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
SCHEMBL7171512 1.00 HSPA5 (0.84) HSPA5HIF1ACYP2C9CYP2C19SMN1; SMN2
SCHEMBL20596953 0.97 HSPA5 (0.78) HSPA5HIF1ACYP2C9CYP2C19SMN1; SMN2
Butylated Hydroxytoluene SCHEMBL9225860 0.97 HSPA5 (0.84) HSPA5HIF1ACYP2C9CYP2C19SMN1; SMN2
SCHEMBL1615304 0.97 CYP2C9 (0.81) HSPA5HIF1ACYP2C9CYP2C19SMN1; SMN2
SCHEMBL30599778 0.92 HSPA5 (1.00) HSPA5HIF1ACYP2C9CYP2C19SMN1; SMN2
SCHEMBL27533 0.92 HSPA5 (1.00) HSPA5HIF1ACYP2C9CYP2C19SMN1; SMN2
SCHEMBL9475586 0.90 HSPA5 (0.96) HSPA5HIF1ACYP2C9CYP2C19SMN1; SMN2
SCHEMBL29351672 0.88 HSPA5 (1.00) HSPA5HIF1ACYP2C9CYP2C19SMN1; SMN2
SCHEMBL34162 0.88 HSPA5 (1.00) HSPA5HIF1ACYP2C9CYP2C19SMN1; SMN2
SCHEMBL29415372 0.88 HSPA5 (1.00) 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
US-20150159109-A1 Lubricant Oil Compositions POLNOX CORPORATION 2015-06-11 US disclosed
EP-0659749-B1 Mixtures of ringalkylated aromated amines and phenothiazines CIBA SC HOLDING AG (CH) 2000-09-20 EP disclosed
EP-0568331-B1 Thread wound golf ball SUMITOMO RUBBER IND (JP) 1995-11-22 EP disclosed
EP-0659749-A1 Mixtures of ringalkylated aromated and phenothiazines CIBA-GEIGY AG (CH) 1995-06-28 EP disclosed
EP-0568331-A1 Thread wound golf ball SUMITOMO RUBBER INDUSTRIES LIMITED (JP) 1993-11-03 EP disclosed