SCHEMBL14564005

SCHEMBL14564005

CC(C)(C)c1cc(CCO)cc(Cc2cc(CCO)cc(C(C)(C)C)c2O)c1O

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSPA5 P11021 2/20 0.69
HIF1A Q16665 4/20 0.56
CYP2C9 P11712 3/20 0.56
CYP2C19 P33261 3/20 0.56
SMN1; SMN2 Q16637 3/20 0.56
CYP2D6 P10635 2/20 0.50
HSD17B10 Q99714 1/20 0.50
ALDH1A1 P00352 7/20 0.47
MAPK1 P28482 3/20 0.47
GSR P00390 2/20 0.47
HPGD P15428 2/20 0.47
MAPT P10636 2/20 0.47
KDM4E B2RXH2 2/20 0.47
HTT P42858 1/20 0.47
TSHR P16473 4/20 0.47
LMNA P02545 3/20 0.47
KMT2A Q03164 3/20 0.47
MEN1 O00255 2/20 0.47
CYP1A2 P05177 2/20 0.47
CYP3A4 P08684 2/20 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
SCHEMBL14002951 0.90 HSPA5 (0.65) HSPA5HIF1ACYP2C9CYP2C19SMN1; SMN2
SCHEMBL14002963 0.88 HSPA5 (0.63) HSPA5HIF1ACYP2C9CYP2C19SMN1; SMN2
SCHEMBL3809095 0.88 HSPA5 (0.62) HSPA5HIF1ACYP2C9CYP2C19SMN1; SMN2
SCHEMBL14003051 0.87 HSPA5 (0.61) HSPA5HIF1ACYP2C9CYP2C19SMN1; SMN2
SCHEMBL14002964 0.87 HSPA5 (0.61) HSPA5HIF1ACYP2C9CYP2C19SMN1; SMN2
SCHEMBL5609679 0.87 ALDH1A1 (0.60) HSPA5HIF1ACYP2C9CYP2C19SMN1; SMN2
SCHEMBL27698933 0.86 HSPA5 (0.51) HSPA5HIF1ACYP2C9CYP2C19SMN1; SMN2
SCHEMBL29976141 0.86 HSPA5 (0.74) HSPA5HIF1ACYP2C9CYP2C19SMN1; SMN2
SCHEMBL3138594 0.86 HSPA5 (0.74) HSPA5HIF1ACYP2C9CYP2C19SMN1; SMN2
SCHEMBL8114199 0.85 HSPA5 (0.73) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070054225-A1 SILVER SALT PHOTOTHERMOGRAPHIC DRY IMAGING MATERIAL KONICA MINOLTA MEDICAL & GRAPHIC, INC. (JP) 2007-03-08 US disclosed