Crotonic Acid

Crotonic Acid

SCHEMBL5086335

C/C=C/C(=O)O.CCN=C=O.OCCO

nearest known ligand 0.31

Full drug profile on Sugi Atlas →

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 1/20 0.31
GABRR1 P24046 2/20 0.30
GABRR2 P28476 2/20 0.30
BLM P54132 2/20 0.30
GABRR3 A8MPY1 1/20 0.30
LMNA P02545 1/20 0.30
TSHR P16473 1/20 0.30
APEX1 P27695 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30
TDP1 Q9NUW8 1/20 0.30

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
Crotonic Acid SCHEMBL27802935 0.94 TSHR (0.33) HCAR2GABRR1GABRR2BLMGABRR3
Di(Hydroxyethyl)Ether SCHEMBL5091469 0.89 TSHR (0.32) HCAR2TSHR
Triethylene Glycol SCHEMBL5091428 0.87 MEN1 (0.33) HCAR2TSHR
Crotonic Acid SCHEMBL305485 0.79 TSHR (0.44) HCAR2GABRR1GABRR2BLMGABRR3
Crotonic Acid SCHEMBL10603685 0.79 TSHR (0.44) HCAR2GABRR1GABRR2BLMGABRR3
Ethylene Glycol SCHEMBL27707394 0.79
Crotonic Acid SCHEMBL3260978 0.75
Crotonic Acid SCHEMBL5706213 0.75
Bicarbonate SCHEMBL27491873 0.75
Bicarbonate SCHEMBL20298902 0.75 FFAR3 (0.35) TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080033076-A1 Olefin Polymer Composition Powder and Modified Olefin Polymer SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2008-02-07 US disclosed
US-20070093606-A1 Method for producing modified polyolefin resin SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-04-26 US disclosed
US-20070093611-A1 Propylene-based resin SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-04-26 US disclosed