SCHEMBL14767013

SCHEMBL14767013

C=CCOc1ccc(COc2ccc(-c3ccc(-c4ccc(OCC)cc4)c(F)c3F)cc2)c(F)c1F

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MGAM O43451 4/20 0.37
GAA P10253 4/20 0.37
SI P14410 4/20 0.37
MGAM2 Q2M2H8 4/20 0.37
MAPT P10636 2/20 0.37
NPC1 O15118 1/20 0.37
POLB P06746 1/20 0.37
RAB9A P51151 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
FFAR1 O14842 3/20 0.36
FFAR4 Q5NUL3 2/20 0.36
CACNA1C Q13936 1/20 0.36
CTSS P25774 2/20 0.36
CTSK P43235 2/20 0.36
CTSL P07711 1/20 0.36
GYS1 P13807 1/20 0.35
LMNA P02545 1/20 0.34
HTR2C P28335 2/20 0.33
HTR2B P41595 2/20 0.33
MEN1 O00255 1/20 0.33

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
SCHEMBL14766157 1.00 MGAM (0.37) MGAMGAASIMGAM2MAPT
SCHEMBL12737044 0.92 FFAR1 (0.40) MGAMGAASIMGAM2MAPT
SCHEMBL12740502 0.92 FFAR1 (0.40) MGAMGAASIMGAM2MAPT
SCHEMBL14766202 0.91 FFAR1 (0.42) MGAMGAASIMGAM2MAPT
SCHEMBL10302456 0.91 MGAM (0.36) MGAMGAASIMGAM2FFAR1
SCHEMBL14766253 0.89 FFAR1 (0.41) MAPTNPC1RAB9AFFAR1FFAR4
SCHEMBL14767163 0.89 FFAR1 (0.41) MAPTNPC1RAB9AFFAR1FFAR4
SCHEMBL14766117 0.88 FFAR1 (0.35) MAPTNPC1RAB9AFFAR1FFAR4
SCHEMBL14766621 0.88 FFAR1 (0.35) MAPTNPC1RAB9AFFAR1FFAR4
SCHEMBL10303263 0.88 CYP2D6 (0.36) MGAMGAASIMGAM2MAPT

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