Propionic Acid

Propionic Acid

SCHEMBL29018259

CCC(=O)O.CCC(=O)O.Cc1ccc(C)c(C)c1C

nearest known ligand 0.53

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR3 O14843 1/20 0.53
SMN1; SMN2 Q16637 3/20 0.43
KMT2A Q03164 2/20 0.39
MCL1 Q07820 1/20 0.39
MEN1 O00255 1/20 0.39
CES2 O00748 1/20 0.38
CES1 P23141 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2C19 P33261 1/20 0.37
TSHR P16473 1/20 0.37
ALDH1A1 P00352 1/20 0.37
GLA P06280 1/20 0.37
STING1 Q86WV6 1/20 0.37
LMNA P02545 1/20 0.37
HSD17B10 Q99714 1/20 0.37
GAA P10253 1/20 0.37
TDP2 O95551 1/20 0.36
NSD2 O96028 1/20 0.36

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
Propionic Acid SCHEMBL11359484 0.87 FFAR3 (0.40) FFAR3SMN1; SMN2KMT2AMCL1MEN1
Glycine SCHEMBL28406983 0.82 GLRA1 (0.50) SMN1; SMN2KMT2AMCL1MEN1NPSR1
Acetic Acid SCHEMBL28703177 0.80 FFAR3 (0.44) FFAR3SMN1; SMN2KMT2AMCL1MEN1
Propionic Acid SCHEMBL3428439 0.80 SMN1; SMN2 (0.38) FFAR3SMN1; SMN2KMT2AMCL1MEN1
O-Xylene SCHEMBL28858177 0.79 TSHR (0.53) FFAR3SMN1; SMN2CES2CES1TSHR
P-Xylene SCHEMBL27949447 0.78 FFAR3 (0.59) FFAR3SMN1; SMN2KMT2AMEN1CES2
SCHEMBL7450427 0.77 HSP90AB1 (0.47) SMN1; SMN2KMT2AMEN1ALDH1A1LMNA
Propionic Acid SCHEMBL27802377 0.76
Propionic Acid SCHEMBL1932778 0.75 FFAR3 (0.62) FFAR3SMN1; SMN2CES2CES1CYP1A2
Butyric Acid SCHEMBL21957825 0.74 FFAR3 (0.46) FFAR3SMN1; SMN2KMT2AMCL1MEN1

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-114394884-B Preparation method of allylphenol compound 暨南大学 2023-06-16 CN disclosed