SCHEMBL14294665

SCHEMBL14294665

C=C(C)c1cc(CC)cc(C(c2cc(CC)cc(C(C)(C)C)c2O)C2C(C)CC(C)CC2C)c1O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSPA5 P11021 1/20 0.38
ALDH1A1 P00352 2/20 0.31
MEN1 O00255 1/20 0.31
GMNN O75496 1/20 0.31
GABBR2 O75899 1/20 0.31
LMNA P02545 1/20 0.31
TP53 P04637 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2C9 P11712 1/20 0.31
ALOX15 P16050 1/20 0.31
TSHR P16473 1/20 0.31
NFKB1 P19838 1/20 0.31
MAPK1 P28482 1/20 0.31
CYP2C19 P33261 1/20 0.31
BLM P54132 1/20 0.31
PMP22 Q01453 1/20 0.31
KMT2A Q03164 1/20 0.31
ATM Q13315 1/20 0.31
HIF1A Q16665 1/20 0.31

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
SCHEMBL14258308 0.90 HSPA5 (0.46) HSPA5ALDH1A1MEN1GMNNGABBR2
SCHEMBL13995374 0.81 HSPA5 (0.47) HSPA5ALDH1A1MEN1GMNNGABBR2
SCHEMBL14294666 0.81 HSPA5 (0.39) HSPA5ALDH1A1LMNACYP1A2CYP3A4
SCHEMBL14258347 0.80 HSPA5 (0.48) HSPA5ALDH1A1MEN1GMNNGABBR2
SCHEMBL13660432 0.78 HSPA5 (0.46) HSPA5ALDH1A1MEN1GMNNGABBR2
SCHEMBL14297245 0.76 HSPA5 (0.36) HSPA5
SCHEMBL14294668 0.76 HSPA5 (0.36) HSPA5ALDH1A1KMT2AKDM4E
SCHEMBL14469824 0.76 HSPA5 (0.43) HSPA5ALDH1A1MEN1GMNNGABBR2
SCHEMBL14294664 0.72 HSPA5 (0.37) HSPA5ALDH1A1CYP1A2CYP3A4CYP2C9
SCHEMBL14294526 0.71 SMN1; SMN2 (0.39) HSPA5ALDH1A1CYP2C9CYP2C19HIF1A

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-20080050683-A1 Photothermographic material FUJIFILM CORPORATION (JP) 2008-02-28 US disclosed