SCHEMBL8950874

SCHEMBL8950874

C/C=C/C1COC(c2ccc(-c3ccc(-c4ccc(OCCCC)c(F)c4F)cc3)cc2F)OC1

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
S1PR1 P21453 1/20 0.32
RARA P10276 1/20 0.31
RARB P10826 1/20 0.31
FPR2 P25090 2/20 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
SCHEMBL8950886 0.97 FPR2 (0.33) S1PR1FPR2
SCHEMBL8950909 0.96 PTPN11 (0.33) FPR2
SCHEMBL8950875 0.96 PTPN11 (0.33) FPR2
SCHEMBL8950900 0.96 PTPN11 (0.33) FPR2
SCHEMBL8950894 0.96 PTPN11 (0.33) FPR2
SCHEMBL8950895 0.95 FPR2 (0.34) FPR2
SCHEMBL8950845 0.92 FPR2 (0.33) FPR2
SCHEMBL8952384 0.91 FPR2 (0.31) FPR2
SCHEMBL8950661 0.90 CNR2 (0.35) S1PR1RARARARBFPR2
SCHEMBL12999759 0.89

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