SCHEMBL8970216

SCHEMBL8970216

CCCCCCCOc1ccc(-c2ccc(-c3ccc(C#CC4COC(CCCCC)OC4)cc3F)cc2)c(F)c1F

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
RARB P10826 1/20 0.32
FPR2 P25090 1/20 0.31
PPARD Q03181 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
SCHEMBL8970345 0.88 ALDH1A1 (0.31)
SCHEMBL8970346 0.87 PTPN11 (0.32) FPR2
SCHEMBL8970337 0.83 PPARD (0.31) PPARD
SCHEMBL8953720 0.83 FPR2 (0.36) RARBFPR2PPARD
SCHEMBL8953695 0.83 FPR2 (0.36) RARBFPR2PPARD
SCHEMBL8953724 0.83 FPR2 (0.36) RARBFPR2PPARD
SCHEMBL8953675 0.83 FPR2 (0.36) RARBFPR2PPARD
SCHEMBL8953332 0.83 FPR2 (0.36) RARBFPR2PPARD
SCHEMBL8953544 0.83 FPR2 (0.36) RARBFPR2PPARD
SCHEMBL8953290 0.83 FPR2 (0.36) RARBFPR2PPARD

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
US-8187494-B2 Four- or five-ring liquid crystal compound having lateral fluorine, liquid crystal composition, and liquid crystal display device JNC CORPORATION (JP) 2012-05-29 US disclosed