SCHEMBL14767221

SCHEMBL14767221

C=CCOc1ccc(OC(=O)c2ccc(-c3ccc(-c4ccc(OCC)cc4)c(F)c3F)cc2)cc1F

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.43
NPC1 O15118 1/20 0.43
POLB P06746 1/20 0.43
RAB9A P51151 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
FFAR1 O14842 5/20 0.41
PPARD Q03181 4/20 0.41
KMT2A Q03164 1/20 0.40
THRB P10828 1/20 0.39
CCNC P24863 1/20 0.39
CDK8 P49336 1/20 0.39
KDM4E B2RXH2 1/20 0.39
FFAR4 Q5NUL3 2/20 0.39
HCRTR1 O43613 1/20 0.38
HCRTR2 O43614 1/20 0.38
PDGFRB P09619 1/20 0.38
PDGFRA P16234 1/20 0.38
TP53 P04637 1/20 0.38
CHRNA7 P36544 1/20 0.37
GYS1 P13807 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
SCHEMBL14767086 0.94 MAPT (0.43) MAPTNPC1POLBRAB9ASMN1; SMN2
SCHEMBL14766535 0.92 MAPT (0.44) MAPTNPC1POLBRAB9ASMN1; SMN2
SCHEMBL14767019 0.92 MAPT (0.46) MAPTNPC1POLBRAB9ASMN1; SMN2
SCHEMBL12742755 0.91 KMT2A (0.38) MAPTNPC1SMN1; SMN2FFAR1PPARD
SCHEMBL14767299 0.91 MAPT (0.45) MAPTFFAR1PPARDKMT2ATHRB
SCHEMBL14767240 0.90 KMT2A (0.41) MAPTNPC1POLBRAB9ASMN1; SMN2
SCHEMBL14766620 0.90 MAPT (0.46) MAPTNPC1POLBRAB9ASMN1; SMN2
SCHEMBL14767289 0.90 MAPT (0.46) MAPTNPC1POLBRAB9ASMN1; SMN2
SCHEMBL14766086 0.89 MAPT (0.45) MAPTNPC1POLBRAB9ASMN1; SMN2
SCHEMBL12823712 0.87 KDM4E (0.38) KDM4EFFAR4GYS1

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