SCHEMBL8732289

SCHEMBL8732289

C=CC1CCC(c2ccc(COCC=CCC)cc2)CC1

nearest known ligand 0.36

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SPHK1 Q9NYA1 3/20 0.33
ESR2 Q92731 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
SCHEMBL8732285 1.00 SPHK1 (0.33) SPHK1ESR2
SCHEMBL8732283 1.00 SPHK1 (0.33) SPHK1ESR2
SCHEMBL8731515 0.96 SPHK1 (0.31) SPHK1
SCHEMBL8731995 0.96 SPHK1 (0.31) SPHK1
SCHEMBL8731989 0.96 SPHK1 (0.31) SPHK1
SCHEMBL8731521 0.96 SPHK1 (0.31) SPHK1
SCHEMBL8731524 0.96 SPHK1 (0.31) SPHK1
SCHEMBL8731519 0.96 SPHK1 (0.31) SPHK1
SCHEMBL8731985 0.96 SPHK1 (0.31) SPHK1
SCHEMBL8731172 0.94 ESR2 (0.35) 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