SCHEMBL8725486

SCHEMBL8725486

C=Cc1ccc(CC[C@H]2CC[C@H](c3ccc(COCCC=CC)cc3)CC2)cc1

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 2/20 0.33
ALOX5 P09917 1/20 0.31
SPHK1 Q9NYA1 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
SCHEMBL8725483 1.00 ESR2 (0.33) ESR2ALOX5SPHK1
SCHEMBL8725490 1.00 ESR2 (0.33) ESR2ALOX5SPHK1
SCHEMBL8725415 0.91
SCHEMBL8725420 0.91
SCHEMBL8725424 0.91
SCHEMBL8726813 0.88 ESR2 (0.33) ESR2ALOX5SPHK1
SCHEMBL8726817 0.88 ESR2 (0.33) ESR2ALOX5SPHK1
SCHEMBL8726807 0.88 ESR2 (0.33) ESR2ALOX5SPHK1
SCHEMBL8726800 0.88 ESR2 (0.33) ESR2ALOX5SPHK1
SCHEMBL8727576 0.85 ESR2 (0.36) ESR2

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
EP-0882695-A1 BENZYL ETHER DERIVATIVES, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY CHISSO CORPORATION (JP) 1998-12-09 EP disclosed