SCHEMBL14767128

SCHEMBL14767128

C=CCCOc1ccc(C(=O)Oc2ccc(-c3ccc(-c4ccc(OCC)cc4)c(F)c3F)cc2)cc1F

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.41
FFAR1 O14842 3/20 0.40
FFAR4 Q5NUL3 2/20 0.40
MAPT P10636 3/20 0.38
THRB P10828 1/20 0.38
PPARD Q03181 2/20 0.38
ALDH1A1 P00352 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
HCRTR1 O43613 1/20 0.37
HCRTR2 O43614 1/20 0.37
LMNA P02545 1/20 0.36
CHRNA7 P36544 2/20 0.36
CCNC P24863 1/20 0.36
CDK8 P49336 1/20 0.36
NPC1 O15118 1/20 0.35
POLB P06746 1/20 0.35
RAB9A P51151 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
PTPN1 P18031 1/20 0.35
PPARG P37231 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
SCHEMBL14767240 0.94 KMT2A (0.41) KMT2AFFAR1FFAR4MAPTTHRB
SCHEMBL14767083 0.93 PRSS1 (0.41) KMT2AFFAR1FFAR4MAPTTHRB
SCHEMBL14767126 0.91 ALDH1A1 (0.44) KMT2AFFAR1FFAR4MAPTTHRB
SCHEMBL12741921 0.91 ALDH1A1 (0.38) KMT2AFFAR1FFAR4MAPTTHRB
SCHEMBL14766216 0.91 MAPT (0.42) KMT2AFFAR1FFAR4MAPTTHRB
SCHEMBL14767086 0.90 MAPT (0.43) KMT2AFFAR1FFAR4MAPTTHRB
SCHEMBL14767151 0.89 KMT2A (0.45) KMT2AFFAR1FFAR4MAPTTHRB
SCHEMBL14767262 0.89 FFAR1 (0.44) KMT2AFFAR1FFAR4MAPTTHRB
SCHEMBL12741928 0.89 ALDH1A1 (0.40) KMT2AFFAR1FFAR4MAPTTHRB
SCHEMBL14766478 0.88 MAPT (0.42) KMT2AFFAR1FFAR4MAPTTHRB

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