SCHEMBL3304585

SCHEMBL3304585

C=C(C)C(=O)OCCO.C=C(CC(C)(C)C)C(=O)O

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.42
TSHR P16473 4/20 0.41
TET2 Q6N021 2/20 0.41
POLB P06746 1/20 0.35
APEX1 P27695 1/20 0.35
HTT P42858 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
ALDH1A1 P00352 2/20 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
SCHEMBL230727 0.83 TSHR (0.38) THRBTSHRTET2
Methacrylic Acid SCHEMBL467445 0.82 THRB (0.53) THRBTSHRPOLBAPEX1HTT
Methacrylic Acid SCHEMBL9453862 0.82 THRB (0.53) THRBTSHRPOLBAPEX1HTT
SCHEMBL5505311 0.81 THRB (0.50) THRBTSHRPOLBAPEX1HTT
SCHEMBL29516143 0.81 THRB (0.46) THRBTSHRPOLBAPEX1HTT
SCHEMBL2670066 0.81 THRB (0.53) THRBTSHRTET2POLBAPEX1
Methacrylic Acid SCHEMBL7623072 0.81 THRB (0.52) THRBTSHRPOLBAPEX1HTT
Methacrylic Acid SCHEMBL29350265 0.81 THRB (0.57) THRBTSHRPOLBAPEX1HTT
Methacrylic Acid SCHEMBL28968671 0.81 THRB (0.52) THRBTSHRPOLBAPEX1HTT
Tert-Butanol SCHEMBL27512753 0.81 THRB (0.52) THRBTSHRPOLBAPEX1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1595926-B1 COATING COMPOSITION DAIKIN IND LTD (JP) 2014-03-26 EP disclosed
US-8293840-B2 Coating composition DAIKIN INDUSTRIES, LTD. (JP) 2012-10-23 US disclosed
US-7807752-B2 Coating composition DAIKIN INDUSTRIES, LTD. (JP) 2010-10-05 US disclosed
US-20100113662-A1 COATING COMPOSITION DAIKIN INDUSTRIES, LTD. (JP) 2010-05-06 US disclosed
US-20060054053-A1 Coating composition DAIKIN INDUSTRIES, LTD. (JP) 2006-03-16 US disclosed
EP-1595926-A1 COATING COMPOSITION Daikin Industries, Ltd. (JP) 2005-11-16 EP disclosed