SCHEMBL477707

SCHEMBL477707

Oc1cccc(C(O)c2ccccc2)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRB1 P08588 2/20 0.52
ADRA1A P35348 2/20 0.52
MIF P14174 1/20 0.52
HTR2A P28223 1/20 0.52
HTR2B P41595 1/20 0.52
HIF1A Q16665 4/20 0.48
TSHR P16473 2/20 0.48
ADRB2 P07550 1/20 0.48
HTR1A P08908 1/20 0.48
ADRA2A P08913 1/20 0.48
ADRB3 P13945 1/20 0.48
ADRA2B P18089 1/20 0.48
ADRA2C P18825 1/20 0.48
NFKB1 P19838 1/20 0.48
DRD1 P21728 1/20 0.48
HTR7 P34969 1/20 0.48
ADRA1B P35368 1/20 0.48
DRD3 P35462 1/20 0.48
RAB9A P51151 1/20 0.48
SLC6A3 Q01959 1/20 0.48

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
SCHEMBL2060109 0.93 ADRB1 (0.57) ADRB1ADRA1AMIFHTR2AHTR2B
SCHEMBL30598700 0.85 SMN1; SMN2 (0.52) TSHRLMNACA12CA2CA9
SCHEMBL26988656 0.84 ADRB1 (0.46) ADRB1ADRA1AMIFHTR2AHTR2B
SCHEMBL11602687 0.82 ADRB1 (0.62) ADRB1ADRA1AMIFHTR2AHTR2B
SCHEMBL19603047 0.80 LMNA (0.58) ADRB1ADRA1AMIFHTR2AHTR2B
Diphenylmethanol SCHEMBL41571 0.80 SMN1; SMN2 (0.61) HIF1ATSHRADRA2AADRA2CLMNA
Diphenylmethanol SCHEMBL11564700 0.80 SMN1; SMN2 (0.61) HIF1ATSHRADRA2AADRA2CLMNA
Diphenylmethanol SCHEMBL10868602 0.80 SMN1; SMN2 (0.61) HIF1ATSHRADRA2AADRA2CLMNA
Diphenylmethanol SCHEMBL6434457 0.80 SMN1; SMN2 (0.61) HIF1ATSHRADRA2AADRA2CLMNA
SCHEMBL11409149 0.79 ADRB1 (0.46) ADRB1ADRA1AMIFHTR2AHTR2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103553920-A Preparation method of phenoxy benzyl acrylic ester SHANGHAI WEIKAI CHEMICALS CO 2014-02-05 CN claimed
CN-1115325-C Method for synthesis of pyrethrin by catalytic esterification of 4-dimethylaminopyridine KAIDA FINE CHEMICAL INDUSTRY C (CN) 2003-07-23 CN claimed
CN-1218030-A Method for synthesis of pyrethrin by catalytic esterification of 4-dimethylaminopyridine KAIDA FINE CHEMICAL INDUSTRY C (CN) 1999-06-02 CN claimed
CN-110467677-A The wide spectrum identification single-chain antibody of pyrethroid pesticide metabolin and its application JIANGSU ACAD AGRICULTURAL SCI 2019-11-19 CN disclosed
CN-110467677-A The wide spectrum identification single-chain antibody of pyrethroid pesticide metabolin and its application JIANGSU ACAD AGRICULTURAL SCI 2019-11-19 CN disclosed
CN-110283457-A Polyarylene sulfide resin composition and its formed products and surface mounted electronic parts DIC株式会社 2019-09-27 CN disclosed
CN-110226239-A Charge-transporting varnish and charge-transporting film using same 日产化学株式会社 2019-09-10 CN disclosed
CN-109516914-A Phenylpropiolic acid micromolecular organic compound and its preparation method and use 华东师范大学 2019-03-26 CN disclosed
CN-109195956-A Microbicidal oxadiazole derivatives 先正达参股股份有限公司 2019-01-11 CN disclosed
CN-109096761-A Polyarylene sulfide resin composition and its formed products and electric-vehicle part DIC株式会社 2018-12-28 CN disclosed
CN-105493310-B Gasket resin combination, its manufacturing method and secondary cell gasket DIC株式会社 2018-11-23 CN disclosed
CN-1364176-A Processes for producing raw polycarbonate resin material and producing polycarbonate resin IDEMITSU PETROCHEMICAL CO (JP) 2002-08-14 CN disclosed
CN-1086386-C Multi-drug resistance modifiers VERTEX PHARMA (US) 2002-06-19 CN disclosed
CN-1300285-A Hydroxyiminoalkanoic Acid Derivatives TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2001-06-20 CN disclosed
CN-1284055-A Derivatives of 2, 2-dimethyl-3- (2-fluorovinyl) cyclopropanecarboxylic acid, preparation method and application thereof as pesticides AVENTIES CROPS SCIENCES GMBH (DE) 2001-02-14 CN disclosed
CN-1235141-A Process for preparing organic compound MITSUI CHEMICALS INC (JP) 1999-11-17 CN disclosed
CN-1218030-A Method for synthesis of pyrethrin by catalytic esterification of 4-dimethylaminopyridine KAIDA FINE CHEMICAL INDUSTRY C (CN) 1999-06-02 CN disclosed
CN-1039991-C Process for preparation of halogenated compounds ZENECA LTD (GB) 1998-09-30 CN disclosed
CN-1088577-A Novel multi-drug resistance modifiers VERTEX PHARMA (US) 1994-06-29 CN disclosed
CN-1063866-A The preparation method of halogenated compound ICI PLC (GB) 1992-08-26 CN disclosed