Crotonic Acid

Crotonic Acid

SCHEMBL28122010

C=CC(=O)OCCCCCC(=O)O.CC=CC(=O)O

nearest known ligand 0.58

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 7/20 0.58
ALDH1A1 P00352 5/20 0.58
CYP3A4 P08684 1/20 0.58
HPGD P15428 1/20 0.49
HCAR2 Q8TDS4 4/20 0.47
ABCC4 O15439 1/20 0.43
MAPT P10636 1/20 0.43
TP53 P04637 2/20 0.41
HIF1A Q16665 2/20 0.41
HSD17B10 Q99714 1/20 0.41
EPHX2 P34913 2/20 0.37
LMNA P02545 1/20 0.36
NFKB1 P19838 1/20 0.36
PMP22 Q01453 1/20 0.36
ATM Q13315 1/20 0.36
THRB P10828 2/20 0.36
PPARG P37231 1/20 0.35
SLC22A6 Q4U2R8 1/20 0.35
SLC22A8 Q8TCC7 1/20 0.35
GPR84 Q9NQS5 1/20 0.35

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
SCHEMBL5059021 0.87 TSHR (0.76) TSHRALDH1A1CYP3A4HPGDHCAR2
Adipic Acid SCHEMBL8593869 0.87 TSHR (0.76) TSHRALDH1A1CYP3A4HPGDHCAR2
SCHEMBL7557446 0.87 TSHR (0.76) TSHRALDH1A1CYP3A4HPGDHCAR2
SCHEMBL10357941 0.87 TSHR (0.76) TSHRALDH1A1CYP3A4HPGDHCAR2
SCHEMBL7557536 0.87 TSHR (0.76) TSHRALDH1A1CYP3A4HPGDHCAR2
SCHEMBL15463347 0.87 TSHR (0.76) TSHRALDH1A1CYP3A4HPGDHCAR2
SCHEMBL93258 0.87 TSHR (0.76) TSHRALDH1A1CYP3A4HPGDHCAR2
SCHEMBL5476526 0.87 TSHR (0.76) TSHRALDH1A1CYP3A4HPGDHCAR2
SCHEMBL7557842 0.87 TSHR (0.76) TSHRALDH1A1CYP3A4HPGDHCAR2
SCHEMBL5488552 0.87 TSHR (0.76) TSHRALDH1A1CYP3A4HPGDHCAR2

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-103045115-B Pressure-sensitive tape film and pressure-sensitive tape 日东电工株式会社 2016-12-21 CN disclosed