Chloroacetic Acid

Chloroacetic Acid

SCHEMBL8439813

O/N=C(Cl)\C(Cl)=N/O.O=C(O)CCl.O=C(O)CCl

nearest known ligand 0.59

Full drug profile on Sugi Atlas →

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.59
LDHA P00338 1/20 0.30
SRR Q9GZT4 1/20 0.30
LMNA P02545 1/20 0.30
ALKBH5 Q6P6C2 1/20 0.30
SUCNR1 Q9BXA5 1/20 0.30
EGLN1 Q9GZT9 1/20 0.30

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
Chloroacetic Acid SCHEMBL4587116 0.80
Propionic Acid SCHEMBL8439677 0.80 FFAR3 (0.56) TSHR
Chloroacetic Acid SCHEMBL19089 0.77
Chloroacetic Acid SCHEMBL1331987 0.77
Chloroacetic Acid SCHEMBL5309413 0.77 TSHR (1.00) TSHRLDHASRRLMNAALKBH5
Chloroacetic Acid SCHEMBL1330649 0.77
Chloroacetic Acid SCHEMBL1330914 0.77
SCHEMBL192650 0.77
SCHEMBL192651 0.77
SCHEMBL15921216 0.77

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0571313-B1 An industrial microbicide and a method for killing microbes for industrial use KATAYAMA CHEMICAL WORKS CO (JP) 1999-03-03 EP disclosed
US-5411990-A Dioxime derivative YOSHITOMI PHARMACEUTICAL INDUSTRIES LTD. (JP) 1995-05-02 US disclosed
EP-0571313-A2 An industrial microbicide and a method for killing microbes for industrial use KATAYAMA CHEMICAL, INC. (JP) 1993-11-24 EP disclosed