SCHEMBL996843

SCHEMBL996843

O=C(CCS)OCC(O)COC(=O)CCS

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.44
DUSP3 P51452 1/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
LMNA P02545 1/20 0.44
LPAR1 Q92633 7/20 0.42
ENPP2 Q13822 6/20 0.42
LPAR4 Q99677 3/20 0.42
LPAR5 Q9H1C0 3/20 0.42
LPAR2 Q9HBW0 3/20 0.42
LPAR3 Q9UBY5 3/20 0.42
LPAR6 P43657 2/20 0.42
MAPT P10636 1/20 0.38
DGKA P23743 1/20 0.38
TRPV1 Q8NER1 2/20 0.36
CES2 O00748 1/20 0.36
FAAH O00519 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
SCHEMBL2227704 0.89 LMNA (0.58) KDM4EDUSP3MEN1KMT2ALMNA
SCHEMBL16944242 0.87 KDM4E (0.44) KDM4EDUSP3MEN1KMT2ALMNA
SCHEMBL1592995 0.83 CYP3A4 (0.42) KDM4EDUSP3MEN1KMT2ALMNA
SCHEMBL19287032 0.82 KDM4E (0.37) KDM4EDUSP3MEN1KMT2ALMNA
SCHEMBL2127406 0.82 MAPT (0.58) KDM4EDUSP3MEN1KMT2ALMNA
SCHEMBL10093737 0.81 LPAR1 (0.41) KDM4EDUSP3MEN1KMT2ALMNA
SCHEMBL16561542 0.80 TSHR (0.42) KDM4EDUSP3MEN1KMT2ALMNA
SCHEMBL6738675 0.79 TSHR (0.43) KDM4EDUSP3MEN1KMT2ALMNA
SCHEMBL29930756 0.79 MAPT (0.41) KDM4EDUSP3MEN1KMT2ALMNA
SCHEMBL11664025 0.79 KDM4E (0.40) KDM4EDUSP3MEN1KMT2ALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8772441-B2 Polyurethanes polymerizable composition and method for producing optical resin of the same MITSUI CHEMICALS, INC. (JP) 2014-07-08 US claimed
US-10308756-B2 Polymerizable composition for optical material and use thereof MITSUI CHEMICALS, INC. (JP) 2019-06-04 US disclosed
US-10040947-B2 Primer composition MITSUI CHEMICALS, INC. (JP) 2018-08-07 US disclosed
EP-3168246-A1 POLYMERIZABLE COMPOSITION FOR OPTICAL MATERIAL, AND APPLICATION FOR SAME Mitsui Chemicals, Inc. (JP) 2017-05-17 EP disclosed
US-20170129989-A1 POLYMERIZABLE COMPOSITION FOR OPTICAL MATERIAL AND USE THEREOF MITSUI CHEMICALS, INC. (JP) 2017-05-11 US disclosed
US-8772441-B2 Polyurethanes polymerizable composition and method for producing optical resin of the same MITSUI CHEMICALS, INC. (JP) 2014-07-08 US disclosed
EP-2258780-B1 PRIMER COMPOSITION MITSUI CHEMICALS INC (JP) 2012-09-26 EP disclosed
US-20110014483-A1 PRIMER COMPOSITION MITSUI CHEMICALS, INC. 2011-01-20 US disclosed
EP-2258780-A1 PRIMER COMPOSITION Mitsui Chemicals, Inc. (JP) 2010-12-08 EP disclosed
US-20070203318-A1 Polyurethanes Polymerizable Composition And Method For Producing Optical Resin Of The Same MITSUI CHEMICALS, INC. (JP) 2007-08-30 US disclosed
EP-1746118-A1 POLYURETHANE POLYMERIZABLE COMPOSITION AND METHOD FOR PRODUCING OPTICAL RESIN COMPOSED OF SAME Mitsui Chemicals, Inc. (JP) 2007-01-24 EP disclosed