SCHEMBL8946026

SCHEMBL8946026

C/C=C/C1CCC(c2ccc(-c3ccc(-c4ccc(OCCCC)c(F)c4F)cc3)cc2F)CO1

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
RARA P10276 1/20 0.32
RARB P10826 1/20 0.32
FPR2 P25090 3/20 0.31
S1PR1 P21453 1/20 0.31
SCN9A Q15858 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
SCHEMBL8946045 0.97 FPR2 (0.34) FPR2
SCHEMBL8946158 0.97 FPR2 (0.33) FPR2
SCHEMBL8946205 0.97 FPR2 (0.33) FPR2
SCHEMBL8946050 0.97 FPR2 (0.33) FPR2
SCHEMBL8945989 0.97 FPR2 (0.33) FPR2
SCHEMBL8946117 0.96 FPR2 (0.35) FPR2
SCHEMBL8946160 0.93 FPR2 (0.33) FPR2
SCHEMBL18718469 0.92 FPR2 (0.37) FPR2
SCHEMBL8947508 0.92 FPR2 (0.33) FPR2
SCHEMBL8945902 0.90 CNR2 (0.36) RARARARBFPR2S1PR1SCN9A

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
EP-2206695-B1 TETRA- OR PENTA-CYCLIC LIQUID CRYSTALLINE COMPOUND HAVING LATERAL FLUORINE, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY ELEMENT JNC CORP (JP) 2013-09-18 EP disclosed
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