SCHEMBL12375060

SCHEMBL12375060

C=C(C)C(=O)Cc1ccc(C(=O)Oc2ccc(CCC(=O)Oc3ccc(COC(=O)C(=C)C)cc3)cc2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 7/20 0.46
MAPT P10636 7/20 0.41
MEN1 O00255 2/20 0.40
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 2/20 0.38
GAA P10253 2/20 0.38
CYP2C9 P11712 2/20 0.38
CYP2C19 P33261 2/20 0.38
TMPRSS2 O15393 2/20 0.37
KLK1 P06870 2/20 0.37
PRSS1 P07477 2/20 0.37
SLC22A2 O15244 1/20 0.37
F2 P00734 1/20 0.37
HPN P05981 1/20 0.37
PRSS2 P07478 1/20 0.37
CTSL P07711 1/20 0.37
CNR1 P21554 1/20 0.37
PRSS3 P35030 1/20 0.37
ADRA1A P35348 1/20 0.37
OPRD1 P41143 1/20 0.37

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
SCHEMBL12375027 0.90 KMT2A (0.43) KMT2AMAPTMEN1ALDH1A1LMNA
SCHEMBL12242517 0.85 KMT2A (0.39) KMT2AMAPTMEN1KDM4EALDH1A1
SCHEMBL12375045 0.85 MAPT (0.41) KMT2AMAPTKDM4EALDH1A1CYP1A2
SCHEMBL12242652 0.84 KMT2A (0.48) KMT2AMAPTMEN1KDM4EALDH1A1
SCHEMBL12375046 0.82 MAPT (0.38) KMT2AMAPTMEN1KDM4EALDH1A1
SCHEMBL12242562 0.82 KMT2A (0.38) KMT2AMAPTMEN1KDM4EALDH1A1
SCHEMBL12375035 0.81 THRB (0.47) KMT2AMAPTALDH1A1LMNAL3MBTL1
SCHEMBL12242670 0.80 MAPT (0.46) KMT2AMAPTMEN1KDM4EALDH1A1
SCHEMBL12242831 0.80 MAPT (0.46) KMT2AMAPTMEN1KDM4EALDH1A1
SCHEMBL12242627 0.80 MAPT (0.46) KMT2AMAPTMEN1KDM4EALDH1A1

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