SCHEMBL8730685

SCHEMBL8730685

C=CCOCc1ccc(-c2ccc([C@H]3CC[C@H]([C@H]4CC[C@H](C=C)CC4)CC3)cc2)cc1

nearest known ligand 0.43

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.30
RAB9A P51151 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
SCHEMBL8730676 1.00 NPC1 (0.30) NPC1RAB9A
SCHEMBL8730666 1.00 NPC1 (0.30) NPC1RAB9A
SCHEMBL8730663 0.96 NPC1 (0.32) NPC1RAB9A
SCHEMBL8727789 0.96 ESR2 (0.31)
SCHEMBL8727785 0.96 ESR2 (0.31)
SCHEMBL8730670 0.96 NPC1 (0.32) NPC1RAB9A
SCHEMBL8730485 0.96 NPC1 (0.32) NPC1RAB9A
SCHEMBL8727792 0.96 ESR2 (0.31)
SCHEMBL8727189 0.86 SPHK1 (0.33)
SCHEMBL8727183 0.86 SPHK1 (0.33)

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