SCHEMBL2014408

SCHEMBL2014408

C=CC(=O)OC(C)(C)O[PH](=O)O

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.33
TSHR P16473 2/20 0.31
ALDH1A1 P00352 1/20 0.31
TP53 P04637 1/20 0.31
CYP3A4 P08684 1/20 0.31
MAPK1 P28482 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
HIF1A Q16665 1/20 0.31
HPGD P15428 1/20 0.31

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
SCHEMBL8965554 0.80 TSHR (0.39) THRBTSHRALDH1A1TP53CYP3A4
SCHEMBL2019491 0.79 THRB (0.37) THRBTSHRALDH1A1TP53CYP3A4
SCHEMBL2014874 0.77 THRB (0.38) THRBTSHRALDH1A1TP53CYP3A4
SCHEMBL17767791 0.77 ALDH1A1 (0.33) TSHRALDH1A1TP53
SCHEMBL1068177 0.74 TSHR (0.35) THRBTSHRALDH1A1TP53CYP3A4
SCHEMBL9862049 0.74 TSHR (0.35) THRBTSHRALDH1A1TP53CYP3A4
SCHEMBL9862055 0.74 TSHR (0.35) THRBTSHRALDH1A1TP53CYP3A4
SCHEMBL11333311 0.74 HCAR2 (0.36) THRBTSHRALDH1A1TP53CYP3A4
SCHEMBL865858 0.73
SCHEMBL29156653 0.72 TSHR (0.34) THRBTSHRALDH1A1TP53CYP3A4

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-20110160400-A1 Phosphoric and Acrylic Copolymer Resin Having Excellent Transparency and Flame Retardancy and Resin Composition Including the Same CHEIL INDUSTRIES INC. (KR) 2011-06-30 US claimed
US-20110160400-A1 Phosphoric and Acrylic Copolymer Resin Having Excellent Transparency and Flame Retardancy and Resin Composition Including the Same CHEIL INDUSTRIES INC. (KR) 2011-06-30 US disclosed