SCHEMBL22630089

SCHEMBL22630089

CCCCCc1ccc(-c2cc3ccc(SCC(F)(F)OC(F)(F)OC(F)(F)OC(F)(F)COC)cc3o2)c(OC(F)(F)F)c1

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.33
CYP2C8 P10632 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
SCHEMBL21735499 0.93 ALOX5 (0.31) ALOX5
SCHEMBL22625098 0.91 GPR55 (0.34)
SCHEMBL22630081 0.89 ALOX5 (0.33) ALOX5
SCHEMBL21735411 0.88 TRPV1 (0.30)
SCHEMBL21735410 0.88 THRB (0.34)
SCHEMBL22630098 0.86
SCHEMBL22628828 0.86
SCHEMBL22628760 0.85 S1PR4 (0.30)
SCHEMBL21735122 0.83 ALOX5 (0.36) ALOX5
SCHEMBL22629183 0.82 ALOX5 (0.37) ALOX5CYP2C8

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-3583091-B1 HYDROPHOBIC COMPOUNDS FOR OPTICALLY ACTIVE DEVICES MERCK PATENT GMBH (DE) 2020-11-04 EP disclosed