Crotonic Acid

Crotonic Acid

SCHEMBL16178256

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

nearest known ligand 0.40

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.40
TP53 P04637 1/20 0.40
EGLN1 Q9GZT9 1/20 0.40
EGLN3 Q9H6Z9 1/20 0.40
PTGS1 P23219 1/20 0.38
ALDH1A1 P00352 2/20 0.34
ALOX15 P16050 1/20 0.34
RECQL P46063 1/20 0.34
HSD17B10 Q99714 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
HCAR2 Q8TDS4 3/20 0.33
AKR1C3 P42330 1/20 0.33
GABRP O00591 2/20 0.32
GABRD O14764 2/20 0.32
GABRA1 P14867 2/20 0.32
GABRB1 P18505 2/20 0.32
GABRG2 P18507 2/20 0.32
GABRB3 P28472 2/20 0.32
GABRA5 P31644 2/20 0.32
GABRA3 P34903 2/20 0.32

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 SCHEMBL28083293 1.00 TSHR (0.40) TSHRTP53EGLN1EGLN3PTGS1
Crotonic Acid SCHEMBL16178258 1.00 TSHR (0.40) TSHRTP53EGLN1EGLN3PTGS1
Fumaric Acid SCHEMBL3815775 0.89 TSHR (0.53) TSHRTP53EGLN1EGLN3PTGS1
Crotonic Acid SCHEMBL27876744 0.85 HTT (0.37) TSHRTP53EGLN1EGLN3PTGS1
Crotonic Acid SCHEMBL28176555 0.83 TSHR (0.50) TSHRTP53EGLN1EGLN3ALDH1A1
Crotonic Acid SCHEMBL1759677 0.83 TSHR (0.50) TSHRTP53EGLN1EGLN3ALDH1A1
Crotonic Acid SCHEMBL9735696 0.83 TSHR (0.50) TSHRTP53EGLN1EGLN3ALDH1A1
SCHEMBL18814 0.83
SCHEMBL1396002 0.83 FFAR3 (0.43) TSHRPTGS1ALDH1A1ALOX15AKR1C3
Crotonic Acid SCHEMBL22034 0.83

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
US-20140315036-A1 Ultraviolet-curable Resin Composition, Cured Product, and Optical Member NIPPON KAYAKU KABUSHIKIKAISHA (JP) 2014-10-23 US disclosed