SCHEMBL12485342

SCHEMBL12485342

C=C(C)C(=O)OC.C=C(CC)C(=O)OCCCCCC.C=CC(=O)OCCCC

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 8/20 0.56
HPGD P15428 1/20 0.55
ALDH1A1 P00352 5/20 0.47
CYP3A4 P08684 1/20 0.47
HCAR2 Q8TDS4 3/20 0.40
ATM Q13315 1/20 0.40
NAAA Q02083 1/20 0.39
POLB P06746 1/20 0.37
APEX1 P27695 1/20 0.37
HTT P42858 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
EPHX1 P07099 1/20 0.37
NPSR1 Q6W5P4 2/20 0.35
MAPT P10636 1/20 0.35
RAB9A P51151 1/20 0.35
RAD52 P43351 1/20 0.35
TP53 P04637 2/20 0.34
HIF1A Q16665 2/20 0.34
HSD17B10 Q99714 1/20 0.34
THRB P10828 1/20 0.34

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
SCHEMBL19350367 0.92 TSHR (0.67) TSHRHPGDALDH1A1CYP3A4HCAR2
SCHEMBL27778295 0.92 TSHR (0.67) TSHRHPGDALDH1A1CYP3A4HCAR2
SCHEMBL668356 0.92 TSHR (0.65) TSHRHPGDALDH1A1CYP3A4HCAR2
Acrylic Acid Methyl Ester SCHEMBL28315077 0.91 TSHR (0.55) TSHRHPGDALDH1A1CYP3A4HCAR2
Acrylic Acid SCHEMBL1581255 0.91 TSHR (0.50) TSHRHPGDALDH1A1CYP3A4HCAR2
Acrylic Acid Methyl Ester SCHEMBL18010680 0.91 TSHR (0.59) TSHRHPGDALDH1A1CYP3A4HCAR2
SCHEMBL8958812 0.91 TSHR (0.63) TSHRHPGDALDH1A1CYP3A4HCAR2
SCHEMBL7974959 0.91 TSHR (0.63) TSHRHPGDALDH1A1CYP3A4HCAR2
SCHEMBL8349812 0.91 TSHR (0.63) TSHRHPGDALDH1A1CYP3A4HCAR2
SCHEMBL978390 0.91 TSHR (0.67) TSHRHPGDALDH1A1CYP3A4HCAR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2655521-B1 POLYMER ENCAPSULATED TITANIUM DIOXIDE PARTICLES ROHM & HAAS (US) 2018-05-30 EP disclosed
EP-2578647-B1 Coating composition with high pigment volume content opaque polymer particle and a polymer encapsulated TiO2 particle ROHM & HAAS (US) 2017-06-14 EP disclosed
EP-2848653-B1 POLYMER ENCAPSULATED TITANIUM DIOXIDE PARTICLES ROHM & HAAS (US) 2017-05-03 EP disclosed
US-9371466-B2 Method of making polymer encapsulated titanium dioxide particles ROHM AND HAAS COMPANY (US) 2016-06-21 US disclosed
US-9234084-B2 Polymer encapsulated titanium dioxide particles ROHM AND HAAS COMPANY (US) 2016-01-12 US disclosed
US-20150079397-A1 POLYMER ENCAPSULATED TITANIUM DIOXIDE PARTICLES ROHM AND HAAS COMPANY 2015-03-19 US disclosed
EP-2848653-A1 Polymer encapsulated titanium dioxide particles Rohm and Haas Company (US) 2015-03-18 EP disclosed
US-20140121305-A1 COMPOSITION CONTAINING ASSOCIATIVE RHEOLOGY MODIFIER AND POLYMER ENCAPSULATED PIGMENT PARTICLES DYKE ANTONY K VAN (US) 2014-05-01 US disclosed
EP-2710078-A1 COMPOSITION CONTAINING ASSOCIATIVE RHEOLOGY MODIFIER AND POLYMER ENCAPSULATED PIGMENT PARTICLES Rohm and Haas Company (US) 2014-03-26 EP disclosed
US-8609759-B2 Coating composition with high pigment volume content opaque polymer ROHM AND HAAS COMPANY (US) 2013-12-17 US disclosed
EP-2655521-A1 POLYMER ENCAPSULATED TITANIUM DIOXIDE PARTICLES Rohm and Haas Company (US) 2013-10-30 EP disclosed
EP-2578647-A1 Coating composition with high pigment volume content opaque polymer particle and a polymer encapsulated TiO2 particle Rohm and Haas Company (US) 2013-04-10 EP disclosed
US-20130085222-A1 COATING COMPOSITION WITH HIGH PIGMENT VOLUME CONTENT OPAQUE POLYMER ROHM AND HAAS COMPANY (US) 2013-04-04 US disclosed
WO-2013002999-A1 COMPOSITION CONTAINING ASSOCIATIVE RHEOLOGY MODIFIER AND POLYMER ENCAPSULATED PIGMENT PARTICLES ROHM AND HAAS COMPANY (US) 2013-01-03 WO disclosed
WO-2012116025-A1 POLYMER ENCAPSULATED TITANIUM DIOXIDE PARTICLES ROHM AND HAAS COMPANY (US) 2012-08-30 WO disclosed