Trichloroacetic Acid

Trichloroacetic Acid

SCHEMBL28481122

CCCC[n+]1ccn(C)c1.O=C([O-])C(Cl)(Cl)Cl

nearest known ligand 0.37

Full drug profile on Sugi Atlas →

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.37
HSP90AA1 P07900 1/20 0.37
KMT2A Q03164 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
FDPS P14324 12/20 0.35
PABPC1 P11940 1/20 0.34

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
Pivalate SCHEMBL18575128 0.90 MEN1 (0.38) MEN1HSP90AA1KMT2ASMN1; SMN2FDPS
Bicarbonate SCHEMBL5032083 0.89 MEN1 (0.41) MEN1HSP90AA1KMT2ASMN1; SMN2FDPS
Trifluoroacetic Acid SCHEMBL302072 0.88 MEN1 (0.37) MEN1HSP90AA1KMT2ASMN1; SMN2FDPS
Acetic Acid SCHEMBL35015 0.88 MEN1 (0.43) MEN1HSP90AA1KMT2ASMN1; SMN2FDPS
Bicarbonate SCHEMBL1490993 0.88 MEN1 (0.40) MEN1HSP90AA1KMT2ASMN1; SMN2FDPS
Bicarbonate SCHEMBL2127090 0.88 MEN1 (0.40) MEN1HSP90AA1KMT2ASMN1; SMN2FDPS
Propionic Acid SCHEMBL358643 0.86 MEN1 (0.39) MEN1HSP90AA1KMT2ASMN1; SMN2FDPS
Glycolic Acid SCHEMBL18575074 0.85 MEN1 (0.38) MEN1HSP90AA1KMT2ASMN1; SMN2FDPS
Succinic Acid SCHEMBL18575091 0.85 CA1 (0.40) MEN1HSP90AA1KMT2ASMN1; SMN2FDPS
Bicarbonate SCHEMBL28941873 0.84 MEN1 (0.42) MEN1HSP90AA1KMT2ASMN1; SMN2

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111825637-B Preparation method of N-methylmorpholine oxide 四川鸿鹏新材料有限公司 2021-05-18 CN claimed
CN-111825637-A Preparation method of N-methylmorpholine oxide 四川鸿鹏新材料有限公司 2020-10-27 CN claimed
CN-111825637-B Preparation method of N-methylmorpholine oxide 四川鸿鹏新材料有限公司 2021-05-18 CN disclosed
CN-111825637-A Preparation method of N-methylmorpholine oxide 四川鸿鹏新材料有限公司 2020-10-27 CN disclosed