Methacrylic Acid

Methacrylic Acid

SCHEMBL14060439

C=C(C)C(=O)O.C=CC(=O)OCCOC(=O)/C=C\C(=O)O

nearest known ligand 0.55

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Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 9/20 0.55
TSHR P16473 7/20 0.50
ALDH1A1 P00352 4/20 0.50
TP53 P04637 3/20 0.50
HIF1A Q16665 3/20 0.50
HSD17B10 Q99714 1/20 0.50
HPGD P15428 1/20 0.46
CYP3A4 P08684 2/20 0.46
THRB P10828 2/20 0.42
ATM Q13315 1/20 0.40
MAPK1 P28482 1/20 0.34
SMN1; SMN2 Q16637 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
SCHEMBL19064242 0.90 HCAR2 (0.51) HCAR2TSHRALDH1A1TP53HIF1A
SCHEMBL448684 0.89 TSHR (0.61) HCAR2TSHRALDH1A1TP53HIF1A
Methacrylic Acid SCHEMBL1664193 0.89 TSHR (0.61) HCAR2TSHRALDH1A1TP53HIF1A
SCHEMBL448685 0.89 TSHR (0.61) HCAR2TSHRALDH1A1TP53HIF1A
SCHEMBL8892905 0.89 TSHR (0.61) HCAR2TSHRALDH1A1TP53HIF1A
Maleic Acid SCHEMBL27672360 0.85 TSHR (0.50) HCAR2TSHRALDH1A1TP53HIF1A
Maleic Acid SCHEMBL3892059 0.85 TSHR (0.67) HCAR2TSHRALDH1A1TP53HIF1A
Methacrylic Acid SCHEMBL28349796 0.84 HCAR2 (0.56) HCAR2TSHRALDH1A1TP53ATM
Methacrylic Acid SCHEMBL16197602 0.84 TSHR (0.73) HCAR2TSHRALDH1A1TP53HIF1A
Methacrylic Acid SCHEMBL16114495 0.82 TSHR (0.53) HCAR2TSHRALDH1A1TP53HIF1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2012160452-A1 TWO-PART POLYMERISABLE COMPOSITIONS HENKEL IRELAND LIMITED (IE) 2012-11-29 WO disclosed