SCHEMBL22277683

SCHEMBL22277683

CCCCOc1ccc(-c2ccc(OCC3CCC(C4CCC(CCC)CC4)CC3)cc2)c(F)c1F

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 3/20 0.36
KDM1A O60341 1/20 0.35
PDE4A P27815 3/20 0.33
PDE4D Q08499 3/20 0.33
PDE3B Q13370 2/20 0.33
PDE3A Q14432 2/20 0.33
PTGES O14684 1/20 0.33
ALOX5 P09917 1/20 0.33
PPARG P37231 1/20 0.33
PSEN1 P49768 1/20 0.33
SSTR5 P35346 1/20 0.33
KCNH2 Q12809 1/20 0.33
FFAR1 O14842 1/20 0.33
PPARD Q03181 1/20 0.33
PDK2 Q15119 1/20 0.33
GRM2 Q14416 1/20 0.32
CHRM2 P08172 1/20 0.32
CHRM4 P08173 1/20 0.32
CHRM5 P08912 1/20 0.32
CHRM1 P11229 1/20 0.32

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
SCHEMBL22277527 0.93 FFAR4 (0.38) FFAR4KDM1ASSTR5KCNH2FFAR1
SCHEMBL15581226 0.90 FFAR4 (0.36) FFAR4KDM1APDE4APDE4DPDE3B
SCHEMBL22277563 0.90 CNR2 (0.34) FFAR4KDM1APDE4APDE4DPDE3B
SCHEMBL22277231 0.89 ALOX5 (0.35) FFAR4KDM1APDE4APDE4DPDE3B
SCHEMBL22277469 0.89 FFAR4 (0.39) FFAR4KDM1ASSTR5KCNH2FFAR1
SCHEMBL3267950 0.89 FFAR4 (0.43) FFAR4FFAR1PPARDGRM2
SCHEMBL1311879 0.89 FFAR4 (0.43) FFAR4FFAR1PPARDGRM2
SCHEMBL12032399 0.88 FFAR4 (0.38) FFAR4KDM1ASSTR5KCNH2FFAR1
SCHEMBL22277216 0.88 CNR2 (0.35) FFAR4KDM1APDE4APDE4DPDE3B
SCHEMBL15445816 0.87 RIPK1 (0.37) FFAR4PDE4APDE4DPTGESALOX5

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