Crotonic Acid

Crotonic Acid

SCHEMBL27396103

C=CCC(=O)O.CC=CC(=O)O.CCC(=O)O

nearest known ligand 0.40

Full drug profile on Sugi Atlas →

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FFAR3 O14843 1/20 0.40
TSHR P16473 3/20 0.33
ALDH1A1 P00352 2/20 0.33
HCAR2 Q8TDS4 2/20 0.32
ABCC4 O15439 1/20 0.32
MAPT P10636 1/20 0.32
CYP2D6 P10635 1/20 0.32
ALOX15 P16050 1/20 0.32
TP53 P04637 1/20 0.31
EGLN1 Q9GZT9 1/20 0.31
EGLN3 Q9H6Z9 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
Crotonic Acid SCHEMBL11525007 0.94 ALOX15 (0.36) TSHRALDH1A1HCAR2ABCC4MAPT
Crotonic Acid SCHEMBL1618932 0.94 ALOX15 (0.36) TSHRALDH1A1HCAR2ABCC4MAPT
Crotonic Acid SCHEMBL2406680 0.94 ALOX15 (0.36) TSHRALDH1A1HCAR2ABCC4MAPT
Propionic Acid SCHEMBL462525 0.85 FFAR3 (0.56) FFAR3TSHRALDH1A1ABCC4MAPT
Crotonic Acid SCHEMBL1238291 0.85 FFAR3 (0.56) FFAR3TSHRALDH1A1HCAR2TP53
Crotonic Acid SCHEMBL1238287 0.85 FFAR3 (0.56) FFAR3TSHRALDH1A1HCAR2TP53
Crotonic Acid SCHEMBL7029699 0.80
Fumaric Acid SCHEMBL4979324 0.80 TSHR (0.50) TSHRALDH1A1HCAR2ABCC4MAPT
Maleic Acid SCHEMBL3703143 0.80 TSHR (0.50) TSHRALDH1A1HCAR2ABCC4MAPT
Fumaric Acid SCHEMBL3703148 0.80 TSHR (0.50) TSHRALDH1A1HCAR2ABCC4MAPT

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
CN-1085775-A Agent for treatment of hair HENKEL KGAA (DE) 1994-04-27 CN disclosed