Bromoacetic Acid

Bromoacetic Acid

SCHEMBL5492312

O=C([O-])CBr.O=C([O-])CBr.[Zn+2]

nearest known ligand 0.56

Full drug profile on Sugi Atlas →

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CA4 P22748 4/20 0.47
TSHR P16473 1/20 0.47
TRPA1 O75762 2/20 0.44
CASP1 P29466 1/20 0.41
FFAR3 O14843 2/20 0.37
HDAC3 O15379 2/20 0.37
HDAC1 Q13547 2/20 0.37
HDAC2 Q92769 2/20 0.37
HDAC8 Q9BY41 2/20 0.37
CA1 P00915 2/20 0.33
CA2 P00918 1/20 0.33
FAHD1 Q6P587 1/20 0.33
KDM4E B2RXH2 1/20 0.32
MAPT P10636 1/20 0.32
ALOX15 P16050 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
ALDH1A1 P00352 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
Bromoacetic Acid SCHEMBL6914854 0.92 CA4 (0.47) CA4TSHRTRPA1CASP1FFAR3
Bromoacetic Acid SCHEMBL11405488 0.92 CA4 (0.47) CA4TSHRTRPA1CASP1FFAR3
Bromoacetic Acid SCHEMBL6916750 0.92 CA4 (0.47) CA4TSHRTRPA1CASP1FFAR3
Bromoacetic Acid SCHEMBL2476064 0.92
Bromoacetic Acid SCHEMBL1000560 0.92
Bromoacetic Acid SCHEMBL2852922 0.92
Bromoacetic Acid SCHEMBL789120 0.92
Bromoacetic Acid SCHEMBL6917043 0.92
Bromoacetic Acid SCHEMBL6914538 0.92
Bromoacetic Acid SCHEMBL6916707 0.92 CA4 (0.47) CA4TSHRTRPA1CASP1FFAR3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114605325-A Preparation method of medical intermediate pyrazole-4-acetic acid hydrochloride 天方药业有限公司 2022-06-10 CN claimed
CN-114605325-A Preparation method of medical intermediate pyrazole-4-acetic acid hydrochloride 天方药业有限公司 2022-06-10 CN disclosed
CN-114605325-A Preparation method of medical intermediate pyrazole-4-acetic acid hydrochloride 天方药业有限公司 2022-06-10 CN disclosed
CN-109232987-B Preparation method of silicon dioxide loaded nano composite material and plastic master batch 上海曦灵化工科技有限公司 2021-02-05 CN disclosed
EP-2562293-A1 SILVER ANTI-TARNISHING AGENT, SILVER ANTI-TARNISHING RESIN COMPOSITION, SILVER ANTI-TARNISHING METHOD, AND LIGHT-EMITTING DIODE USING SAME Nippon Kayaku Kabushiki Kaisha (JP) 2013-02-27 EP disclosed
US-20130032853-A1 Silver Anti-Tarnishing Agent, Silver Anti-Tarnishing Resin Composition, Silver Anti-Tarnishing Method, And Light-Emitting Diode Using Same NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2013-02-07 US disclosed
EP-1746082-A1 Salts of zinc and aliphatic haloid carboxylic acids for therapy of skin neoplasms and visible mucous coats Tsyb, Anatoly Fyodorovich (RU) 2007-01-24 EP disclosed
US-6830704-B2 Contains a Lewis acid metal salt and a compound having clathrating ability. TOAGOSEI CO., LTD. (JP) 2004-12-14 US disclosed
US-20030135016-A1 Contains a Lewis acid metal salt and a compound having clathrating ability. TOAGOSEI CO., LTD. 2003-07-17 US disclosed
US-6547985-B1 Adhesive mixture TOGOSEI CO., LTD. (JP) 2003-04-15 US disclosed