Crotonic Acid

Crotonic Acid

SCHEMBL28124165

C=CC(=O)OCC(C)C(=O)O.CC=CC(=O)O

nearest known ligand 0.53

Full drug profile on Sugi Atlas →

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TSHR P16473 7/20 0.53
HPGD P15428 1/20 0.36
ALDH1A1 P00352 4/20 0.35
TP53 P04637 3/20 0.35
HIF1A Q16665 3/20 0.35
CYP3A4 P08684 2/20 0.35
HSD17B10 Q99714 1/20 0.35
HCAR2 Q8TDS4 5/20 0.34
MAPK1 P28482 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
THRB P10828 2/20 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
SCHEMBL2524719 0.88 TSHR (0.67) TSHRHPGDALDH1A1TP53HIF1A
Crotonic Acid SCHEMBL27650753 0.87 TSHR (0.56) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL28189984 0.86 TSHR (0.64) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL2472765 0.83 TSHR (0.39) TSHRHPGDALDH1A1HCAR2
Acrylic Acid Ethyl Ester SCHEMBL28059697 0.78 HCAR2 (0.59) TSHRHPGDALDH1A1TP53HIF1A
Maleic Acid SCHEMBL3330980 0.78 TSHR (0.62) TSHRHPGDALDH1A1TP53HIF1A
Fumaric Acid SCHEMBL11785039 0.78 TSHR (0.62) TSHRHPGDALDH1A1TP53HIF1A
Sorbic Acid SCHEMBL28134434 0.76 TSHR (0.51) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL28310659 0.75 TSHR (0.69) TSHRHPGDALDH1A1TP53HIF1A
Crotonic Acid SCHEMBL9681122 0.75 TSHR (0.68) TSHRHPGDALDH1A1TP53HIF1A

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
CN-106459302-A UV curable acrylic copolymers 汉高股份有限及两合公司 2017-02-22 CN claimed
CN-106459313-A Curable adhesive compositions and use thereof 汉高知识产权控股有限责任公司 2017-02-22 CN disclosed