SCHEMBL477338

SCHEMBL477338

COc1cccc(C(O)c2ccccc2)c1

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
AOC3 Q16853 2/20 0.54
L3MBTL1 Q9Y468 1/20 0.53
CASR P41180 1/20 0.51
PKM P14618 1/20 0.51
MTNR1A P48039 2/20 0.50
MTNR1B P49286 2/20 0.50
BRD4 O60885 2/20 0.49
CREBBP Q92793 1/20 0.49
CA4 P22748 1/20 0.48
CHRM2 P08172 1/20 0.48
CHRM1 P11229 1/20 0.48
CHRM3 P20309 1/20 0.48
CNR2 P34972 1/20 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
SCHEMBL27686957 1.00 AOC3 (0.54) AOC3L3MBTL1CASRPKMMTNR1A
SCHEMBL2093768 0.94 AOC3 (0.59) AOC3L3MBTL1CASRPKMBRD4
Acetic Acid SCHEMBL28094254 0.93 MTNR1A (0.56) AOC3L3MBTL1MTNR1AMTNR1B
SCHEMBL4822561 0.89 AOC3 (0.54) AOC3L3MBTL1PKMBRD4CREBBP
SCHEMBL3470936 0.87 AOC3 (0.50) AOC3L3MBTL1CASRPKMMTNR1A
SCHEMBL4819668 0.86 BRD4 (0.57) AOC3L3MBTL1CASRBRD4CREBBP
SCHEMBL23882846 0.86 ROCK1 (0.50) AOC3L3MBTL1PKMBRD4
SCHEMBL9438783 0.86 LMNA (0.49) AOC3L3MBTL1CASRPKMBRD4
SCHEMBL6598474 0.86 IGF1R (0.50) AOC3L3MBTL1PKMBRD4CHRM2
SCHEMBL6791737 0.86 MTNR1A (0.56) AOC3L3MBTL1PKMMTNR1AMTNR1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3688000-B1 HYDROCARBON-SOLUBLE HALOGEN AND THIOLATE/MAGNESIUM EXCHANGE REAGENTS ALBEMARLE GERMANY GMBH (DE) 2023-11-08 EP disclosed
US-11236113-B2 Hydrocarbon-soluble halogen and thiolate/magnesium exchange reagents ALBEMARLE GERMANY GMBH (DE) 2022-02-01 US disclosed
EP-3109703-B1 PHOTOSENSITIZATION CHEMICAL-AMPLIFICATION TYPE RESIST MATERIAL, AND METHOD FOR FORMING PATTERN USING SAME TOKYO ELECTRON LTD (JP) 2020-12-30 EP disclosed
US-20200239496-A1 Hydrocarbon-Soluble Halogen and Thiolate/Magnesium Exchange Reagents Ludwig-Maximilians-Universitat München (DE) 2020-07-30 US disclosed
CN-109053754-B Synthetic method for constructing polysubstituted chroman compound based on biomass source 2, 5-dimethylfuran dearomatization cycloaddition strategy 青岛农业大学 2020-04-07 CN disclosed
WO-2019063418-A1 HYDROCARBON-SOLUBLE HALOGEN AND THIOLATE/MAGNESIUM EXCHANGE REAGENTS ALBEMARLE GERMANY GMBH (DE) 2019-04-04 WO disclosed
US-10025187-B2 Photosensitization chemical-amplification type resist material, method for forming pattern using same, semiconductor device, mask for lithography, and template for nanoimprinting TOKYO ELECTRON LIMITED (JP) 2018-07-17 US disclosed
US-10018911-B2 Chemically amplified resist material and resist pattern-forming method JSR CORPORATION (JP) 2018-07-10 US disclosed
US-10018911-B2 Chemically amplified resist material and resist pattern-forming method JSR CORPORATION (JP) 2018-07-10 US disclosed
US-9971247-B2 Pattern-forming method OSAKA UNIVERSITY (JP) 2018-05-15 US disclosed
EP-2810072-A1 COMPOSITIONS AND METHODS FOR DETECTION OF METHODONE METABOLITE Siemens Healthcare Diagnostics Inc. (US) 2014-12-10 EP disclosed
US-20140221626-A1 COMPOSITIONS AND METHODS FOR DETECTION OF METHADONE METABOLITE SIEMENS HEALTHCARE DIAGNOSTICS INC. (US) 2014-08-07 US disclosed
US-8771964-B2 Compositions and methods for detection of methadone metabolite SIEMENS HEALTHCARE DIAGNOSTICS INC. (US) 2014-07-08 US disclosed
US-8563786-B2 Method for producing optically active alcohol MITSUI CHEMICALS, INC. (JP) 2013-10-22 US disclosed
US-20130203076-A1 COMPOSITIONS AND METHODS FOR DETECTION OF METHADONE METABOLITE SIEMENS HEALTHCARE DIAGNOSTICS INC. (US) 2013-08-08 US disclosed
WO-2013116088-A1 COMPOSITIONS AND METHODS FOR DETECTION OF METHODONE METABOLITE SIEMENS HEALTHCARE DIAGNOSTICS INC. (US) 2013-08-08 WO disclosed
US-20120088938-A1 METHOD FOR PRODUCING OPTICALLY ACTIVE ALCOHOL AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2012-04-12 US disclosed
EP-2412694-A1 PROCESS FOR PRODUCING OPTICALLY ACTIVE ALCOHOL Mitsui Chemicals, Inc. (JP) 2012-02-01 EP disclosed
US-5236952-A Inhibit the enzyme catechol-O-methyltransferase; for treatment of Parkinson's disease administered with L-dopa HOFFMANN-LA ROCHE INC. (US) 1993-08-17 US disclosed
US-4138488-A Diphenylmethyl picolinic acid derivatives and their use as anti-acne agents SCHERING CORPORATION (US) 1979-02-06 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (7 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-10025187-B2 Photosensitization chemical-amplification type resist material, method for forming pattern using same, semiconductor device, mask for lithography, and template for nanoimprinting ASIC1, ASIC3, CLTA AOC3 4095/4885L3MBTL1 3448/4885CASR 120/4885
US-20140221626-A1 COMPOSITIONS AND METHODS FOR DETECTION OF METHADONE METABOLITE DNPEP, OPRD1, NPEPPS AOC3 2715/4885L3MBTL1 415/4885CASR 4463/4885
US-20200239496-A1 Hydrocarbon-Soluble Halogen and Thiolate/Magnesium Exchange Reagents OR10J3, MSRB3, SLC39A3 AOC3 44/4885L3MBTL1 2069/4885CASR 617/4885
US-20130203076-A1 COMPOSITIONS AND METHODS FOR DETECTION OF METHADONE METABOLITE DNPEP, OPRD1, NPEPPS AOC3 2715/4885L3MBTL1 415/4885CASR 4463/4885
US-20120088938-A1 METHOD FOR PRODUCING OPTICALLY ACTIVE ALCOHOL ADH1A, ADH1C, FHIT AOC3 246/4885L3MBTL1 4093/4885CASR 4058/4885
US-10018911-B2 Chemically amplified resist material and resist pattern-forming method SLC11A2, XRCC5, RAD54L AOC3 3396/4885L3MBTL1 4063/4885CASR 46/4885
US-11236113-B2 Hydrocarbon-soluble halogen and thiolate/magnesium exchange reagents MSRB3, OR10J3, GFER AOC3 67/4885L3MBTL1 1701/4885CASR 499/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.