SCHEMBL4048577

SCHEMBL4048577

C=CCc1cc(Cc2cc(C)cc(C(C)(C)C)c2O)c(OC(=O)C=C)c(C(C)(C)C)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSPA5 P11021 2/20 0.50
HIF1A Q16665 3/20 0.49
CYP2C9 P11712 2/20 0.49
CYP2C19 P33261 2/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
CYP2D6 P10635 2/20 0.45
HSD17B10 Q99714 1/20 0.45
GAA P10253 1/20 0.35
ALDH1A1 P00352 2/20 0.35
CA2 P00918 1/20 0.35
POLB P06746 1/20 0.35
TYR P14679 1/20 0.35
VCAM1 P19320 4/20 0.32
MEN1 O00255 1/20 0.32
USP2 O75604 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP3A4 P08684 1/20 0.32
MAPT P10636 1/20 0.32
TSHR P16473 1/20 0.32
MAPK1 P28482 1/20 0.32

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
SCHEMBL11068059 0.95 HSPA5 (0.47) HSPA5HIF1ACYP2C9CYP2C19SMN1; SMN2
SCHEMBL35108 0.91 HSPA5 (0.60) HSPA5HIF1ACYP2C9CYP2C19SMN1; SMN2
SCHEMBL29350305 0.91 HSPA5 (0.60) HSPA5HIF1ACYP2C9CYP2C19SMN1; SMN2
SCHEMBL29362485 0.91 HSPA5 (0.60) HSPA5HIF1ACYP2C9CYP2C19SMN1; SMN2
SCHEMBL25365322 0.91 HSPA5 (0.55) HSPA5HIF1ACYP2C9CYP2C19SMN1; SMN2
Methane SCHEMBL29094014 0.90 HSPA5 (0.58) HSPA5HIF1ACYP2C9CYP2C19SMN1; SMN2
SCHEMBL4052698 0.88 HSPA5 (0.44) HSPA5HIF1ACYP2C9CYP2C19SMN1; SMN2
SCHEMBL3849274 0.86 HSPA5 (0.46) HSPA5HIF1ACYP2C9CYP2C19SMN1; SMN2
SCHEMBL7194890 0.85 HSPA5 (0.47) HSPA5HIF1ACYP2C9CYP2C19SMN1; SMN2
SCHEMBL5665033 0.85 HSPA5 (0.52) 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-1099982-B1 STABLE PHOTOSENSITIVE RESIN COMPOSITION ASAHI KASEI CHEMICALS CORP (JP) 2009-04-29 EP claimed
US-6383716-B1 RESIN WITH BIS(3,5-DI-T-BUTYL-4-HYDROXY-BENZYL) SULFIDE. THE PHOTOSENSITIVE RESIN COMPOSITION OF THIS INVENTION, AS IT CONTAINS A STABILIZER ASAHI KASEI KABUSHIKI KAISHA (JP) 2002-05-07 US claimed
EP-1099982-A1 STABLE PHOTOSENSITIVE RESIN COMPOSITION Asahi Kasei Kabushiki Kaisha (JP) 2001-05-16 EP claimed
US-6383716-B1 RESIN WITH BIS(3,5-DI-T-BUTYL-4-HYDROXY-BENZYL) SULFIDE. THE PHOTOSENSITIVE RESIN COMPOSITION OF THIS INVENTION, AS IT CONTAINS A STABILIZER ASAHI KASEI KABUSHIKI KAISHA (JP) 2002-05-07 US disclosed
EP-1099982-A1 STABLE PHOTOSENSITIVE RESIN COMPOSITION Asahi Kasei Kabushiki Kaisha (JP) 2001-05-16 EP disclosed