Chloroacetic Acid

Chloroacetic Acid

SCHEMBL5874831

CC(O)N(C(C)O)C(C)O.O=C(O)CCl

nearest known ligand 0.53

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.53
ALDH1A1 P00352 6/20 0.36
TP53 P04637 2/20 0.36
LMNA P02545 4/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
MAPT P10636 2/20 0.33
SLC22A6 Q4U2R8 1/20 0.33
PTGS2 P35354 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C19 P33261 1/20 0.33
LDHA P00338 1/20 0.33
SRR Q9GZT4 1/20 0.33
NPC1 O15118 1/20 0.33
HTT P42858 1/20 0.33
RAB9A P51151 1/20 0.33
KMT2A Q03164 1/20 0.33
BBOX1 O75936 1/20 0.32
GABRP O00591 2/20 0.32
GABRD O14764 2/20 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
Malonic Acid SCHEMBL4864852 0.83 LDHA (0.53) ALDH1A1TP53LMNASMN1; SMN2MAPT
Chloroacetic Acid SCHEMBL27370382 0.83
Chloroacetic Acid SCHEMBL11685748 0.83 TSHR (0.67) TSHRALDH1A1TP53LMNASMN1; SMN2
Propionic Acid SCHEMBL3844795 0.81 FFAR3 (0.56) ALDH1A1TP53LMNAMAPTSLC22A6
Succinic Acid SCHEMBL5874469 0.81 EGLN1 (0.50) ALDH1A1LMNAGABRPGABRDGABRA1
Chloroacetic Acid SCHEMBL11154843 0.80 TSHR (0.62) TSHRALDH1A1TP53LMNASMN1; SMN2
Bicarbonate SCHEMBL5874276 0.80 TP53 (0.47) TSHRALDH1A1TP53LMNACYP2D6
Glycine SCHEMBL3747355 0.79 GLRA1 (0.53) ALDH1A1TP53LMNAMAPTSLC22A6
Chloroacetic Acid SCHEMBL5874432 0.79 TSHR (0.53) TSHRALDH1A1TP53LMNASMN1; SMN2
Lactic Acid SCHEMBL28965415 0.78 TP53 (0.65) TSHRALDH1A1TP53SMN1; SMN2SLC22A6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7128976-B2 Composition for film formation, method of film formation, and silica-based film JSR CORPORATION (JP) 2006-10-31 US disclosed
US-20030091838-A1 Composition for film formation, method of film formation, and silica-based film JSR CORPORATION (JP) 2003-05-15 US disclosed