Anisole

Anisole

SCHEMBL641375

COc1ccccc1.[Al+3].[Cl-].[Cl-].[Cl-]

nearest known ligand 0.88

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ACHEBDKRB2CHRM1CHRM2CHRM3CHRNA1CHRNB1CHRNDCHRNECHRNGGUCY1A1GUCY1A2GUCY1B1GUCY1B2NAMPTPTAFRSLC10A2SLC6A2SLC6A3TACR1dacAdacBdacCftsImrcAmrcBmrdA

The experimentally established mechanism targets of Anisole. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE known ✓ P22303 2/20 0.48
CA4 P22748 2/20 0.88
LTA4H P09960 3/20 0.70
CA1 P00915 3/20 0.59
CA2 P00918 3/20 0.59
CA7 P43166 3/20 0.59
CA9 Q16790 3/20 0.59
CA12 O43570 2/20 0.59
CA14 Q9ULX7 2/20 0.59
TRPA1 O75762 1/20 0.54
CES2 O00748 1/20 0.50
CES1 P23141 1/20 0.50
TSHR P16473 1/20 0.47
DRD2 P14416 1/20 0.47
DRD4 P21917 1/20 0.47
DRD3 P35462 1/20 0.47
CLK4 Q9HAZ1 1/20 0.46
CYP1A2 P05177 1/20 0.46
CYP2A6 P11509 1/20 0.46
MAPK1 P28482 1/20 0.46

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
Anisole SCHEMBL28062631 1.00 CA4 (0.88) CA4LTA4HCA1CA2CA7
Anisole SCHEMBL7554435 0.94 CA4 (0.88) CA4LTA4HCA1CA2CA7
Anisole SCHEMBL14954294 0.94 CA4 (0.88) CA4LTA4HCA1CA2CA7
Anisole SCHEMBL28012985 0.94 CA4 (0.88) CA4LTA4HCA1CA2CA7
Anisole SCHEMBL14954300 0.94 CA4 (0.88) CA4LTA4HCA1CA2CA7
Anisole SCHEMBL20328417 0.94
Anisole SCHEMBL1205 0.94
Anisole SCHEMBL28813915 0.94 CA4 (1.00) CA4LTA4HCA1CA2CA7
Anisole SCHEMBL30601749 0.94
Anisole SCHEMBL2493788 0.94 CA4 (1.00) CA4LTA4HCA1CA2CA7

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
WO-2007122628-A1 IMPROVED PROCESS FOR PREPARATION OF HIGHLY PURE CEFOTETAN DISODIUM LUPIN LIMITED (IN) 2007-11-01 WO claimed
EP-4370507-A1 HYDROGENATED QUINOXALINES Otsuka Pharmaceutical Co., Ltd. (JP) 2024-05-22 EP disclosed
CN-117616013-A Hydrogenated quinoxalines 大塚制药株式会社 2024-02-27 CN disclosed
WO-2023286768-A1 HYDROGENATED QUINOXALINES OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2023-01-19 WO disclosed
CN-105481848-A Cefotetan active ester and high purity cefotetan acid preparation method CHONGQINGG TIANDI PHARMACEUTICAL CO LTD CHINA 2016-04-13 CN disclosed
CN-103524449-B Method for synthesizing 2-amino-N-(2-chloro-6-methylphenyl)thiazole-5-carboxamide SHANDONG BOYUAN PHARMACEUTICAL CO LTD 2015-06-03 CN disclosed
CN-103524449-A Method for synthesizing 2-amino-N-(2-chloro-6-methylphenyl)thiazole-5-carboxamide SHANDONG BOYUAN PHARMACEUTICAL CO LTD 2014-01-22 CN disclosed
US-8541573-B2 Substituted sulfonamide compounds GRUENENTHAL GMBH (DE) 2013-09-24 US disclosed
US-8318769-B2 Substituted sulfonamide compounds GRUENETHAL GMBH (DE) 2012-11-27 US disclosed
CN-102718780-A Preparation method of cefmetazole sodium WEINA LIU 2012-10-10 CN disclosed
WO-1993003042-A1 6-ETHYLIDENE PENEM DERIVATIVES SMITHKLINE BEECHAM PLC (GB) 1993-02-18 WO disclosed
EP-0430037-A2 Process for producing 2-carbon-substituted carbapenem derivatives BANYU PHARMACEUTICAL CO., LTD. (JP) 1991-06-05 EP disclosed
US-4931434-A Penem compounds BEECHAM GROUP P.L.C. (GB) 1990-06-05 US disclosed
EP-0321187-A1 6-(Substituted methylene)penems BEECHAM GROUP PLC (GB) 1989-06-21 EP disclosed
US-4684641-A BACTERICIDES PFIZER INC. (US) 1987-08-04 US disclosed
CN-85105749-A The method for preparing cephalosporin antibiotic 1986-12-31 CN disclosed
EP-0168177-A2 Cephalosporin antibiotics Pfizer Limited (GB) 1986-01-15 EP disclosed
US-4376770-A OXACEPHALOSPORINS SHIONOGI & CO., LTD. (JP) 1983-03-15 US disclosed
US-4135045-A PROCESS FOR POLYMERIZATION OF OLEFINS AND CATALYST COMPOSITION THEREFOR MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1979-01-16 US disclosed
US-4048415-A TITANIUM-ALUMINUM COORDINATION CATALYSTS MITSUI PETROCHEMICAL INDUSTRIES LTD. (JA) 1977-09-13 US disclosed