SCHEMBL14767262

SCHEMBL14767262

C=CCCOc1ccc(OC(=O)c2ccc(-c3ccc(-c4ccc(OCC)cc4)c(F)c3F)cc2)c(F)c1

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 5/20 0.44
FFAR4 Q5NUL3 3/20 0.44
MAPT P10636 4/20 0.42
L3MBTL1 Q9Y468 2/20 0.40
ALDH1A1 P00352 1/20 0.40
PPARD Q03181 3/20 0.39
KMT2A Q03164 2/20 0.39
TP53 P04637 1/20 0.38
THRB P10828 1/20 0.38
FAAH O00519 1/20 0.38
CCNC P24863 1/20 0.37
CDK8 P49336 1/20 0.37
HCRTR1 O43613 1/20 0.37
HCRTR2 O43614 1/20 0.37
LMNA P02545 1/20 0.36
MAPK1 P28482 1/20 0.36
CHRNA7 P36544 1/20 0.36

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
SCHEMBL14766369 0.95 FFAR1 (0.44) FFAR1FFAR4MAPTL3MBTL1ALDH1A1
SCHEMBL14767225 0.94 FAAH (0.44) FFAR1FFAR4MAPTL3MBTL1ALDH1A1
SCHEMBL14767240 0.92 KMT2A (0.41) FFAR1FFAR4MAPTL3MBTL1ALDH1A1
SCHEMBL14767234 0.92 ALDH1A1 (0.45) FFAR1FFAR4MAPTL3MBTL1ALDH1A1
SCHEMBL12742806 0.91 FFAR1 (0.36) FFAR1FFAR4MAPTL3MBTL1ALDH1A1
SCHEMBL14766899 0.91 S1PR1 (0.43) FFAR1FFAR4MAPTL3MBTL1ALDH1A1
SCHEMBL14766216 0.91 MAPT (0.42) FFAR1FFAR4MAPTL3MBTL1ALDH1A1
SCHEMBL14767019 0.90 MAPT (0.46) FFAR1FFAR4MAPTPPARDKMT2A
SCHEMBL14767313 0.90 MAPT (0.42) FFAR1FFAR4MAPTL3MBTL1ALDH1A1
SCHEMBL14766478 0.90 MAPT (0.42) FFAR1FFAR4MAPTL3MBTL1ALDH1A1

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