SCHEMBL7965281

SCHEMBL7965281

Cc1ccccc1OCc1ccccc1C(=O)Cl

nearest known ligand 0.60

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.54
HTT P42858 1/20 0.54
RXRA P19793 1/20 0.50
RXRB P28702 1/20 0.50
RXRG P48443 1/20 0.50
PTGDR2 Q9Y5Y4 2/20 0.48
ALDH1A1 P00352 2/20 0.47
SGMS2 Q8NHU3 1/20 0.46
MRGPRX4 Q96LA9 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
RECQL P46063 1/20 0.45
CDK4 P11802 1/20 0.44
CCND1 P24385 1/20 0.44
TRPM8 Q7Z2W7 2/20 0.44
FOLH1 Q04609 1/20 0.44
CYP1A2 P05177 1/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43

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
SCHEMBL8782203 0.86 MRGPRX4 (0.52) TP53HTTPTGDR2SGMS2MRGPRX4
SCHEMBL8782045 0.86 TP53 (0.55) TP53HTTPTGDR2ALDH1A1SGMS2
SCHEMBL8948906 0.86 RXRA (0.51) TP53HTTRXRARXRBRXRG
SCHEMBL5291219 0.86 HTT (0.68) TP53HTTRXRARXRBRXRG
SCHEMBL7537186 0.85 PTGDR2 (0.50) TP53HTTPTGDR2ALDH1A1MRGPRX4
SCHEMBL8783048 0.85 MRGPRX4 (0.50) TP53HTTMRGPRX4FOLH1
SCHEMBL9262462 0.84 TP53 (0.48) TP53HTTRXRARXRBRXRG
SCHEMBL9021287 0.84 TP53 (0.48) TP53HTTRXRARXRBRXRG
SCHEMBL8782013 0.84 MRGPRX4 (0.60) TP53HTTPTGDR2MRGPRX4CYP1A2
SCHEMBL9442052 0.83 L3MBTL1 (0.52) TP53HTTRXRARXRBRXRG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112697943-A Method for analyzing content of 2- (2-methylphenoxymethyl) benzoyl chloride 京博农化科技有限公司 2021-04-23 CN claimed
EP-0718279-B1 Process for the preparation of o-substituted benzoylcyanides BASF AG (DE) 1997-09-24 EP claimed
EP-0493711-A1 Process for the preparation of E-oximethers from phenylglyoxylic acid esters BASF Aktiengesellschaft (DE) 1992-07-08 EP claimed
CN-110396054-B Green synthesis method of kresoxim-methyl 京博农化科技有限公司 2022-09-20 CN disclosed
CN-112697943-A Method for analyzing content of 2- (2-methylphenoxymethyl) benzoyl chloride 京博农化科技有限公司 2021-04-23 CN disclosed
CN-112697943-A Method for analyzing content of 2- (2-methylphenoxymethyl) benzoyl chloride 京博农化科技有限公司 2021-04-23 CN disclosed
CN-112697943-A Method for analyzing content of 2- (2-methylphenoxymethyl) benzoyl chloride 京博农化科技有限公司 2021-04-23 CN disclosed
US-6177459-B1 WELL TOLERATED BY PLANTS BAYER AKTIENGESELLSCHAFT (DE) 2001-01-23 US disclosed
EP-0718279-B1 Process for the preparation of o-substituted benzoylcyanides BASF AG (DE) 1997-09-24 EP disclosed
EP-0493711-B1 Process for the preparation of E-oximethers from phenylglyoxylic acid esters BASF AG (DE) 1996-09-25 EP disclosed
EP-0718279-A1 Process for the preparation of o-substituted benzoylcyanides BASF AKTIENGESELLSCHAFT (DE) 1996-06-26 EP disclosed
US-5221762-A Reacting a phenol with benzolactone compound; then phosgene or thionyl chloride; esterification with alcohol BASF AKTIENGESELLSCHAFT (DE) 1993-06-22 US disclosed
EP-0493711-A1 Process for the preparation of E-oximethers from phenylglyoxylic acid esters BASF Aktiengesellschaft (DE) 1992-07-08 EP disclosed