SCHEMBL13826212

SCHEMBL13826212

CC(CCl)COc1ccc(C(C)(C)c2ccc(C(C)(C)c3ccc(OCC(O)CO)cc3)cc2)cc1

nearest known ligand 0.82

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ AR P10275 6/20 0.82
▸ HTT P42858 2/20 0.58
▸ HIF1A Q16665 1/20 0.58
▸ KMT2A Q03164 3/20 0.46
▸ KDM4E B2RXH2 3/20 0.43
▸ MAPT P10636 2/20 0.43
▸ ALDH1A1 P00352 2/20 0.43
▸ GAA P10253 1/20 0.43
▸ MAPK1 P28482 2/20 0.41
▸ TSHR P16473 1/20 0.41
▸ MEN1 O00255 2/20 0.41
▸ NPC1 O15118 1/20 0.40
▸ RAB9A P51151 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ VDR P11473 6/20 0.39
▸ LMNA P02545 1/20 0.39
▸ HSD17B10 Q99714 1/20 0.39
▸ MITF O75030 1/20 0.39
▸ NPSR1 Q6W5P4 1/20 0.39

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
SCHEMBL14707519 1.00 AR (0.82) ARHTTHIF1AKMT2AKDM4E
SCHEMBL12267221 1.00 AR (0.82) ARHTTHIF1AKMT2AKDM4E
SCHEMBL14707518 1.00 AR (0.82) ARHTTHIF1AKMT2AKDM4E
SCHEMBL14707517 1.00 AR (0.82) ARHTTHIF1AKMT2AKDM4E
SCHEMBL14707520 1.00 AR (0.82) ARHTTHIF1AKMT2AKDM4E
SCHEMBL12267198 0.92 AR (0.76) ARHTTHIF1AKMT2AKDM4E
SCHEMBL12267194 0.90 AR (1.00) ARHTTHIF1AKMT2AKDM4E
SCHEMBL12267202 0.90 AR (0.74) ARHTTHIF1AKMT2AKDM4E
SCHEMBL15257224 0.90 AR (1.00) ARHTTHIF1AKMT2AKDM4E
SCHEMBL13736034 0.90 AR (1.00) ARHTTHIF1AKMT2AKDM4E

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
WO-2012145328-A1 DIBENZYLPHENYL COMPOUNDS AND METHODS FOR THEIR USE THE UNIVERSITY OF BRITISH COLUMBIA (CA) 2012-10-26 — — WO disclosed
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