Propionic Acid

Propionic Acid

SCHEMBL28276458

CCC(=O)O.O=C(Cl)CCl

nearest known ligand 0.62

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR3 O14843 2/20 0.62
TSHR P16473 6/20 0.53
ALDH1A1 P00352 6/20 0.39
TP53 P04637 1/20 0.39
HDAC3 O15379 1/20 0.38
HDAC1 Q13547 1/20 0.38
HDAC2 Q92769 1/20 0.38
HDAC8 Q9BY41 1/20 0.38
TDP1 Q9NUW8 4/20 0.37
BBOX1 O75936 1/20 0.35
AKR1B1 P15121 1/20 0.33
PPARG P37231 4/20 0.32
PPARD Q03181 4/20 0.32
PPARA Q07869 4/20 0.32
GPR84 Q9NQS5 3/20 0.32
HDAC11 Q96DB2 3/20 0.32
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
SLC22A6 Q4U2R8 1/20 0.32
SLC22A8 Q8TCC7 1/20 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
SCHEMBL11085808 0.87 TSHR (0.47) FFAR3TSHRALDH1A1TP53TDP1
SCHEMBL27512943 0.87 TSHR (0.47) FFAR3TSHRALDH1A1TP53TDP1
Propionic Acid SCHEMBL11065979 0.87 TSHR (0.71) FFAR3TSHRALDH1A1HDAC3HDAC1
Propionic Acid SCHEMBL11085840 0.83
Propionic Acid SCHEMBL28114088 0.83
Propionic Acid SCHEMBL10628132 0.81 FFAR3 (0.62) FFAR3TSHRALDH1A1TP53HDAC3
Alcohol SCHEMBL28831836 0.80
Acetic Acid SCHEMBL27689136 0.80
Propionic Acid SCHEMBL6815788 0.80 FFAR3 (0.71) FFAR3TSHRALDH1A1TP53HDAC3
Propionic Acid SCHEMBL5178395 0.80

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-109400463-A The preparation method of 2- positive propoxy chloroacetic chloride 北京颖泰嘉和生物科技股份有限公司 2019-03-01 CN disclosed