SCHEMBL12375055

SCHEMBL12375055

C=CC(=O)COc1ccc(CCC(=O)Oc2ccc(-c3ccc(COC(=O)C(=C)C)cc3)cc2)cc1

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 7/20 0.40
KMT2A Q03164 3/20 0.40
THRB P10828 2/20 0.38
FFAR4 Q5NUL3 2/20 0.34
POLB P06746 1/20 0.34
APEX1 P27695 1/20 0.34
HTT P42858 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
MEN1 O00255 1/20 0.33
GAA P10253 1/20 0.33
AKR1C3 P42330 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
SCHEMBL12375029 1.00 FFAR1 (0.40) FFAR1KMT2ATHRBFFAR4POLB
SCHEMBL12375024 0.84 THRB (0.43) FFAR1KMT2ATHRBFFAR4MEN1
SCHEMBL16541707 0.83 THRB (0.46) FFAR1KMT2ATHRBHTT
SCHEMBL12375027 0.82 KMT2A (0.43) FFAR1KMT2ATHRBHTTMEN1
SCHEMBL12375020 0.81 THRB (0.43) FFAR1KMT2ATHRBFFAR4POLB
SCHEMBL12375021 0.80 KMT2A (0.42) FFAR1KMT2APOLBAPEX1HTT
SCHEMBL22600436 0.79 THRB (0.52) FFAR1KMT2ATHRBPOLBAPEX1
SCHEMBL17433325 0.78 KMT2A (0.54) FFAR1KMT2ATHRBHTT
SCHEMBL12375080 0.78 HTT (0.47) FFAR1KMT2ATHRBPOLBAPEX1
SCHEMBL13963265 0.78 AKR1B10 (0.35) KMT2ATHRBMEN1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8440101-B2 Liquid crystal composition containing polymerizable compound and liquid crystal display element using the same DIC CORPORATION (JP) 2013-05-14 US disclosed
US-20110186776-A1 LIQUID CRYSTAL COMPOSITION CONTAINING POLYMERIZABLE COMPOUND AND LIQUID CRYSTAL DISPLAY ELEMENT USING THE SAME DIC CORPORATION (JP) 2011-08-04 US disclosed