SCHEMBL8648409

SCHEMBL8648409

CCCCc1cc(F)c(OC[C@H]2CC[C@H](C3CC=C(F)CC3)CC2)c(F)c1

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
THRA P10827 1/20 0.30
THRB P10828 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
SCHEMBL9067199 1.00 THRA (0.30) THRATHRB
SCHEMBL8647442 0.97 CNR1 (0.31)
SCHEMBL9067447 0.97 CNR1 (0.31)
SCHEMBL8653450 0.93 THRA (0.31) THRATHRB
SCHEMBL9066808 0.93 THRA (0.31) THRATHRB
SCHEMBL9068101 0.89 FFAR4 (0.31)
SCHEMBL8650125 0.89 FFAR4 (0.31)
SCHEMBL8646060 0.79 OPRM1 (0.30)
SCHEMBL8646062 0.79 OPRM1 (0.30)
SCHEMBL8653311 0.77 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5800734-A 1-fluorocyclohexene-difluorophenyl derivatives ROLIC AG (CH) 1998-09-01 US disclosed
EP-0736513-A1 1-Fluorcyclohexene-difluorphenyl derivatives F. HOFFMANN-LA ROCHE AG (CH) 1996-10-09 EP disclosed