SCHEMBL14766257

SCHEMBL14766257

C=CCOc1ccc(-c2ccc(OCc3ccc(-c4ccc(OCC)cc4)c(F)c3F)cc2)c(F)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 4/20 0.39
▸ FFAR1 O14842 3/20 0.38
▸ FFAR4 Q5NUL3 3/20 0.38
▸ MGAM O43451 3/20 0.38
▸ GAA P10253 3/20 0.38
▸ SI P14410 3/20 0.38
▸ MGAM2 Q2M2H8 3/20 0.38
▸ MAPT P10636 2/20 0.37
▸ SMN1; SMN2 Q16637 2/20 0.37
▸ NPC1 O15118 1/20 0.37
▸ POLB P06746 1/20 0.37
▸ RAB9A P51151 1/20 0.37
▸ CACNA1C Q13936 1/20 0.36
▸ GYS1 P13807 2/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ MAOA P21397 2/20 0.35
▸ ALDH2 P05091 1/20 0.35
▸ PPARD Q03181 1/20 0.35

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
SCHEMBL14767044 0.95 MAOB (0.40) MAOBFFAR1FFAR4MGAMGAA
SCHEMBL12737138 0.91 FFAR1 (0.41) MAOBFFAR1FFAR4MGAMGAA
SCHEMBL14766204 0.91 FFAR1 (0.43) MAOBFFAR1FFAR4NPC1RAB9A
SCHEMBL14766225 0.89 FFAR1 (0.41) MAOBFFAR1FFAR4MAPTCACNA1C
SCHEMBL12737127 0.89 FFAR1 (0.38) MAOBFFAR1FFAR4NPC1RAB9A
SCHEMBL14766076 0.88 MAOB (0.37) MAOBFFAR1FFAR4MGAMGAA
SCHEMBL10302509 0.88 MAOB (0.39) MAOBFFAR1FFAR4MGAMGAA
SCHEMBL14766157 0.87 MGAM (0.37) MAOBFFAR1FFAR4MGAMGAA
SCHEMBL14767013 0.87 MGAM (0.37) MAOBFFAR1FFAR4MGAMGAA
SCHEMBL12823432 0.86 CYP2D6 (0.38) MAOBMGAMGAASIMGAM2

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-8394294-B2 Four-ring liquid crystal compound having lateral fluorine, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2013-03-12 — — US disclosed
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