SCHEMBL2017671

SCHEMBL2017671

C=C(C)C(=O)OCC(CCC)(CCC)O[PH](=O)O

nearest known ligand 0.40

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.40
THRB P10828 1/20 0.38
ALDH1A1 P00352 2/20 0.33
LMNA P02545 1/20 0.31
HSD17B10 Q99714 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
SCHEMBL2015804 0.89 THRB (0.41) TSHRTHRBALDH1A1
SCHEMBL165954 0.80 TSHR (0.44) TSHRTHRBALDH1A1LMNAHSD17B10
SCHEMBL8630149 0.80 TSHR (0.44) TSHRTHRBALDH1A1LMNAHSD17B10
SCHEMBL15955620 0.79 THRB (0.41) TSHRTHRBALDH1A1
SCHEMBL2022717 0.77 TSHR (0.40) TSHRTHRBALDH1A1
SCHEMBL26107155 0.75 TSHR (0.40) TSHRTHRBALDH1A1LMNAHSD17B10
SCHEMBL8850423 0.75 TSHR (0.46) TSHRTHRBALDH1A1LMNAHSD17B10
SCHEMBL16291137 0.74 TSHR (0.40) TSHRTHRBALDH1A1
SCHEMBL2245821 0.74 TSHR (0.48) TSHRTHRBALDH1A1LMNAHSD17B10
SCHEMBL8851060 0.74 TSHR (0.48) TSHRTHRBALDH1A1LMNAHSD17B10

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