SCHEMBL2391075

SCHEMBL2391075

CC(C(=O)O)c1cccc(CBr)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 11/20 0.54
PTGS1 P23219 10/20 0.54
CXCR1 P25024 4/20 0.54
CXCR2 P25025 4/20 0.54
LMNA P02545 4/20 0.54
MAPT P10636 3/20 0.54
SLC22A6 Q4U2R8 3/20 0.54
SMN1; SMN2 Q16637 2/20 0.54
PMP22 Q01453 2/20 0.54
CXCL8 P10145 2/20 0.54
HPGD P15428 2/20 0.54
HIF1A Q16665 2/20 0.54
RECQL P46063 1/20 0.54
KDM4E B2RXH2 1/20 0.54
ALDH1A1 P00352 1/20 0.54
CYP3A4 P08684 1/20 0.54
MAPK1 P28482 1/20 0.54
HSD17B10 Q99714 1/20 0.54
THPO P40225 1/20 0.54
AKR1C3 P42330 4/20 0.47

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
SCHEMBL3242802 1.00 PTGS2 (0.54) PTGS2PTGS1CXCR1CXCR2LMNA
SCHEMBL10276277 1.00 PTGS2 (0.54) PTGS2PTGS1CXCR1CXCR2LMNA
SCHEMBL27697908 0.88 PTGS1 (0.40) PTGS2PTGS1CXCR1CXCR2LMNA
SCHEMBL9425565 0.84 PTGS2 (0.56) PTGS2PTGS1CXCR1CXCR2LMNA
SCHEMBL3674499 0.84 PTGS2 (0.69) PTGS2PTGS1CXCR1CXCR2LMNA
SCHEMBL66534 0.83 PTGS2 (0.64) PTGS2PTGS1CXCR1CXCR2LMNA
SCHEMBL2319534 0.83 PTGS2 (0.58) PTGS2PTGS1CXCR1CXCR2LMNA
SCHEMBL1345158 0.83 PTGS2 (0.64) PTGS2PTGS1CXCR1CXCR2LMNA
SCHEMBL29393183 0.83 PTGS2 (0.64) PTGS2PTGS1CXCR1CXCR2LMNA
SCHEMBL6903957 0.83 PTGS2 (0.58) PTGS2PTGS1CXCR1CXCR2LMNA

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 93 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109776300-A The synthetic method of loxoprofen sodium 浙江大学 2019-05-21 CN claimed
CN-105461678-B A kind of new process synthesizing 2- (4 ' -2-bromomethylphenyl) propionic acid intermediate ketal 武汉工程大学 2019-01-18 CN claimed
CN-109180464-A Gas circulation method prepares 2- (4- 2-bromomethylphenyl) propionic acid 浙江大学 2019-01-11 CN claimed
CN-109180470-A Liquid phase circulation method prepares 2- (4- 2-bromomethylphenyl) propionic acid 浙江大学 2019-01-11 CN claimed
CN-108586233-A The method for synthesizing 2- (4 ' -2-bromomethylphenyl) propionic ester 湖北迅达药业股份有限公司 2018-09-28 CN claimed
CN-107473960-A Pipelineization prepares the method and its device of 2 (4 2-bromomethylphenyl) propionic acid 浙江工业大学 2017-12-15 CN claimed
CN-105214692-B Supported solid catalyst and preparation method thereof and its application 湖北迅达药业股份有限公司 2017-09-29 CN claimed
CN-105131035-B Amino group compound and sugar chain labeled mass spectrum derivatization reagent with positive charges 延边大学 2017-03-22 CN claimed
CN-104744237-B A kind of 2-(4-2-bromomethylphenyl) propanoic acid preparation method 浙江博聚新材料有限公司 2016-08-24 CN claimed
CN-105218351-A A kind of synthetic method of loxoprofen sodium SHANGHAI RECORDCHEM TECHNOLOGY CO LTD 2016-01-06 CN claimed
CN-105017009-A Loxoprofen sodium synthesis method CHEER FINE PHARMACEUTICAL ANHUI CO LTD 2015-11-04 CN claimed
CN-104744237-A Preparation method of 2-(4-bromomethylphenyl) propionic acid LISHUI NANMING CHEMICAL CO LTD 2015-07-01 CN claimed
CN-103265426-B Environment-friendly preparation method of 2 - (4 - Bromomethylphenyl) propionic acid based on two-phase free radical reaction FUJIAN SANTAI BIOLOG PHARMACY CO LTD 2015-07-01 CN claimed
CN-104447284-A Synthetic method of 2-(4-bromomethyl phenyl) propionic acid CHEER FINE PHARMACEUTICAL ANHUI CO LTD 2015-03-25 CN claimed
CN-103265426-A Environment-friendly preparation method of 2 - (4 - Bromomethylphenyl) propionic acid based on two-phase free radical reaction FUJIAN SANTAI BIOLOG PHARMACY CO LTD 2013-08-28 CN claimed
CN-101412670-B Method for synthesizing loxoprofen sodium ZHEJIANG APELOA PHARMACEUTICAL SCIENCE & TECHNOLOGY CO LTD 2011-11-09 CN claimed
CN-101412670-A Method for synthesizing loxoprofen sodium ZHEJIANG PULUO PHARMACEUTICAL (CN) 2009-04-22 CN claimed
CN-101062892-A Synthesis of 2-(4-Bromomethylphenyl) ethylformic acid HANGZHOU PENTATOMIC SCIENCE & (CN) 2007-10-31 CN claimed
CN-1101802-C Process for preparing loxoprofen sodium UNIV FUDAN (CN) 2003-02-19 CN claimed
CN-1294115-A Process for preparing loxoprofen sodium UNIV FUDAN (CN) 2001-05-09 CN claimed