SCHEMBL14767299

SCHEMBL14767299

CCOc1ccc(-c2ccc(-c3ccc(C(=O)Oc4ccc(OCC)c(F)c4)cc3)c(F)c2F)cc1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.45
KMT2A Q03164 3/20 0.45
FFAR1 O14842 5/20 0.45
PPARD Q03181 4/20 0.45
CCNC P24863 1/20 0.44
CDK8 P49336 1/20 0.44
THRB P10828 2/20 0.44
FFAR4 Q5NUL3 2/20 0.44
HCRTR1 O43613 1/20 0.42
HCRTR2 O43614 1/20 0.42
PDGFRB P09619 1/20 0.42
PDGFRA P16234 1/20 0.42
TP53 P04637 1/20 0.41
LMNA P02545 1/20 0.40
PARP10 Q53GL7 1/20 0.40

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
SCHEMBL14767285 0.93 MAPT (0.46) MAPTKMT2AFFAR1THRBFFAR4
SCHEMBL14767114 0.93 MAPT (0.47) MAPTKMT2AFFAR1PPARDTHRB
SCHEMBL12742721 0.93 MAPT (0.43) MAPTKMT2AFFAR1PPARDCCNC
SCHEMBL12742738 0.93 THRB (0.43) MAPTKMT2AFFAR1PPARDTHRB
SCHEMBL14767151 0.93 KMT2A (0.45) MAPTKMT2AFFAR1PPARDCCNC
SCHEMBL12742736 0.92 MAPT (0.42) MAPTKMT2AFFAR1PPARDCCNC
SCHEMBL14767138 0.92 MAPT (0.48) MAPTKMT2AFFAR1PPARDCCNC
SCHEMBL14766610 0.91 MAPT (0.48) MAPTKMT2AFFAR1PPARDCCNC
SCHEMBL14767221 0.91 MAPT (0.43) MAPTKMT2AFFAR1PPARDCCNC
SCHEMBL12742723 0.90 MAPT (0.50) MAPTFFAR1PPARDTHRBFFAR4

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