SCHEMBL8961389

SCHEMBL8961389

C/C=C/CCC1CCC(C2CCC(c3ccc(-c4ccc(-c5ccc(OCC)c(F)c5F)cc4)cc3F)CC2)CC1

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 1/20 0.35
DGAT1 O75907 1/20 0.33
OPRL1 P41146 8/20 0.32
GRIN1 Q05586 1/20 0.31
GRIN2B Q13224 1/20 0.31
NAAA Q02083 1/20 0.31

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
SCHEMBL8934545 0.97 FFAR4 (0.36) FFAR4DGAT1OPRL1GRIN1GRIN2B
SCHEMBL8961506 0.94 FFAR4 (0.34) FFAR4DGAT1OPRL1
SCHEMBL8961539 0.93 FFAR4 (0.33) FFAR4DGAT1
SCHEMBL8961501 0.92 FFAR4 (0.33) FFAR4DGAT1
SCHEMBL8961480 0.92 DGAT1 (0.35) FFAR4DGAT1OPRL1GRIN1GRIN2B
SCHEMBL8962893 0.92 FPR2 (0.31)
SCHEMBL8961453 0.92 FFAR4 (0.33) FFAR4DGAT1
SCHEMBL8961470 0.92 FFAR4 (0.33) FFAR4DGAT1
SCHEMBL8961549 0.92 FFAR4 (0.33) FFAR4DGAT1
SCHEMBL8961479 0.92 FFAR4 (0.33) FFAR4DGAT1

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-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
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