SCHEMBL14294668

SCHEMBL14294668

C=C(C)c1cc(CC)cc(C(c2cc(CC)cc(C(C)(C)C)c2O)C2CCCCO2)c1O

nearest known ligand 0.36

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HSPA5 P11021 1/20 0.36
KMT2A Q03164 1/20 0.32
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 1/20 0.30
GAA P10253 1/20 0.30

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
SCHEMBL14258312 0.91 HSPA5 (0.43) HSPA5KMT2AKDM4EALDH1A1GAA
SCHEMBL14258329 0.87 HSPA5 (0.43) HSPA5KMT2AKDM4EALDH1A1GAA
SCHEMBL14297245 0.86 HSPA5 (0.36) HSPA5
SCHEMBL14294666 0.84 HSPA5 (0.39) HSPA5KDM4EALDH1A1GAA
SCHEMBL13995374 0.79 HSPA5 (0.47) HSPA5KMT2AKDM4EALDH1A1GAA
SCHEMBL14294665 0.76 HSPA5 (0.38) HSPA5KMT2AKDM4EALDH1A1
SCHEMBL13660432 0.76 HSPA5 (0.46) HSPA5KMT2AKDM4EALDH1A1GAA
SCHEMBL14258331 0.75 HSPA5 (0.43) HSPA5KMT2AKDM4EALDH1A1GAA
SCHEMBL14469824 0.74 HSPA5 (0.43) HSPA5KMT2AKDM4EALDH1A1GAA
SCHEMBL14294528 0.73 KDM4E (0.33) KDM4EALDH1A1GAA

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