SCHEMBL22277667

SCHEMBL22277667

C=CCCc1ccc(C2CCC(C3CCC(OCc4ccc(OCC)c(F)c4F)CC3)CC2)cc1

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.32
FFAR4 Q5NUL3 1/20 0.31
SPHK1 Q9NYA1 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
SCHEMBL22277615 0.90 SPHK1 (0.33) SPHK1
SCHEMBL22277641 0.89 FFAR4 (0.32) NAAAFFAR4
SCHEMBL22277281 0.89 SPHK1 (0.35) NAAAFFAR4SPHK1
SCHEMBL22277658 0.86 CYP2C9 (0.32) SPHK1
SCHEMBL22277744 0.86 SPHK1 (0.46) NAAAFFAR4SPHK1
SCHEMBL12759548 0.84 ALOX5 (0.34)
SCHEMBL12759532 0.83 NAAA (0.32) NAAA
SCHEMBL22277590 0.82 SPHK1 (0.32) FFAR4SPHK1
SCHEMBL9925009 0.82 MAPT (0.34) FFAR4SPHK1
SCHEMBL22277567 0.81 NAAA (0.35) NAAA

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-20200239775-A1 TETRACYCLIC LIQUID CRYSTAL COMPOUND HAVING DIATOMIC BONDING GROUP AND 2,3-DIFLUOROPHENYLENE, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC CORPORATION (JP) 2020-07-30 US disclosed