SCHEMBL2349337

SCHEMBL2349337

CCc1cc(Cc2cc(CC)c(O)c(C(C)(C)C)c2)cc(C(C)(C)C)c1O

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSPA5 P11021 2/20 0.73
HIF1A Q16665 4/20 0.50
CYP2C9 P11712 3/20 0.50
CYP2C19 P33261 3/20 0.50
SMN1; SMN2 Q16637 3/20 0.50
ALDH1A1 P00352 6/20 0.47
KMT2A Q03164 4/20 0.47
TSHR P16473 3/20 0.47
MAPK1 P28482 3/20 0.47
MEN1 O00255 3/20 0.47
MAPT P10636 3/20 0.47
CYP1A2 P05177 2/20 0.47
CYP3A4 P08684 2/20 0.47
BLM P54132 2/20 0.47
ATM Q13315 2/20 0.47
NPSR1 Q6W5P4 2/20 0.47
CYP2D6 P10635 2/20 0.47
USP2 O75604 1/20 0.47
GAA P10253 4/20 0.47
LMNA P02545 3/20 0.47

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
SCHEMBL18902069 0.98 HSPA5 (0.71) HSPA5HIF1ACYP2C9CYP2C19SMN1; SMN2
SCHEMBL8963095 0.94 HSPA5 (0.66) HSPA5HIF1ACYP2C9CYP2C19SMN1; SMN2
SCHEMBL14089294 0.91 HSPA5 (0.83) HSPA5HIF1ACYP2C9CYP2C19SMN1; SMN2
SCHEMBL57329 0.90 HSPA5 (0.82) HSPA5HIF1ACYP2C9CYP2C19SMN1; SMN2
SCHEMBL10822034 0.87 HSPA5 (0.66) HSPA5HIF1ACYP2C9CYP2C19SMN1; SMN2
SCHEMBL11248433 0.86 HSPA5 (0.76) HSPA5HIF1ACYP2C9CYP2C19SMN1; SMN2
SCHEMBL9475140 0.86 HSPA5 (0.70) HSPA5HIF1ACYP2C9CYP2C19SMN1; SMN2
SCHEMBL221382 0.85 HSPA5 (0.64) HSPA5HIF1ACYP2C9CYP2C19SMN1; SMN2
SCHEMBL10821851 0.85 HSPA5 (0.64) HSPA5HIF1ACYP2C9CYP2C19SMN1; SMN2
SCHEMBL10821947 0.85 HSPA5 (0.64) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2528979-A1 EPOXY-BASED PRIMER COMPOSITIONS Hempel A/S (DK) 2012-12-05 EP disclosed
WO-2011092278-A1 EPOXY-BASED PRIMER COMPOSITIONS HEMPEL A/S (DK) 2011-08-04 WO disclosed
EP-0244445-A1 LAMINATED STRUCTURES OF POLYETHYLENE TEREPHTHALATE AND ELASTOMERIC COPOLYESTERETHERS. EASTMAN KODAK CO (US) 1987-11-11 EP disclosed
WO-1987002331-A1 LAMINATED STRUCTURES OF POLYETHYLENE TEREPHTHALATE AND ELASTOMERIC COPOLYESTERETHERS EASTMAN KODAK COMPANY (US) 1987-04-23 WO disclosed