SCHEMBL31048

SCHEMBL31048

COCc1ccccc1OC

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 2/20 0.69
TAAR1 Q96RJ0 1/20 0.57
CHRM2 P08172 4/20 0.55
CHRM1 P11229 1/20 0.55
CA1 P00915 2/20 0.55
CA2 P00918 2/20 0.55
CA7 P43166 2/20 0.55
CA9 Q16790 2/20 0.55
ABCB1 P08183 1/20 0.55
CA12 O43570 1/20 0.55
CA4 P22748 1/20 0.55
CA14 Q9ULX7 1/20 0.55
ALDH1A1 P00352 1/20 0.53
GAA P10253 1/20 0.53
MAPT P10636 1/20 0.53
SIGMAR1 Q99720 1/20 0.50
AOC3 Q16853 1/20 0.50
GRIN1 Q05586 3/20 0.48
GRIN2A Q12879 3/20 0.48
BCHE P06276 2/20 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
SCHEMBL31290863 1.00 IDO1 (0.69) IDO1TAAR1CHRM2CHRM1CA1
SCHEMBL6931451 0.86 IDO1 (0.52) IDO1TAAR1CHRM2CHRM1CA1
SCHEMBL10607688 0.86 IDO1 (0.69) IDO1TAAR1CHRM2CHRM1CA1
SCHEMBL26654 0.86 IDO1 (0.69) IDO1TAAR1CHRM2CHRM1CA1
SCHEMBL18649739 0.82 IDO1 (0.64) IDO1TAAR1CHRM2CHRM1CA1
SCHEMBL10519540 0.82 IDO1 (0.64) IDO1TAAR1CHRM2CHRM1CA1
SCHEMBL1520836 0.82 IDO1 (1.00) IDO1TAAR1CHRM2CHRM1ABCB1
SCHEMBL6889926 0.82 IDO1 (0.64) IDO1TAAR1CHRM2CHRM1CA1
SCHEMBL11987565 0.82 IDO1 (0.64) IDO1TAAR1CHRM2CHRM1CA1
SCHEMBL2356061 0.82 IDO1 (0.64) IDO1TAAR1CHRM2CHRM1CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2508504-B1 PROCESS FOR PREPARATION OF CYCLOALKANEDICARBOXYLIC ACID MONOESTERS SUMITOMO CHEMICAL CO (JP) 2016-04-13 EP claimed
EP-2508504-A1 PROCESS FOR PREPARATION OF CYCLOALKANEDICARBOXYLIC ACID MONOESTERS Sumitomo Chemical Co., Ltd (JP) 2012-10-10 EP claimed
JP-7291883-A None JP disclosed
WO-2023210623-A1 HALOALKYL SULFONE ANILIDE COMPOUND AND HERBICIDE CONTAINING SAME 株式会社エス・ディー・エス バイオテック 2023-11-02 WO disclosed
US-20230337672-A1 METHOD OF CONTROLLING SOYBEAN RUST FUNGUS HAVING RESISTANCE TO QoI FUNGICIDE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2023-10-26 US disclosed
US-20230337672-A1 METHOD OF CONTROLLING SOYBEAN RUST FUNGUS HAVING RESISTANCE TO QoI FUNGICIDE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2023-10-26 US disclosed
WO-2023168077-A1 PHENOL-BASED HOT MELT ADHESIVES FOR REWORK, REPAIR AND RECYCLE CONAGEN INC. (US) 2023-09-07 WO disclosed
US-20230232827-A1 METHOD FOR CONTROLLING SOYBEAN RUST FUNGUS RESISTANT TO QoI FUNGICIDES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2023-07-27 US disclosed
US-20230232827-A1 METHOD FOR CONTROLLING SOYBEAN RUST FUNGUS RESISTANT TO QoI FUNGICIDES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2023-07-27 US disclosed
CN-115160098-B Oxygen-containing compound deoxidization methylation method 中国科学院兰州化学物理研究所 2023-06-06 CN disclosed
CN-115160098-A Oxygen-containing compound deoxidation and methylation method 中国科学院兰州化学物理研究所 2022-10-11 CN disclosed
EP-0739333-A1 SELECTIVE ASYMMETRIC HYDROGENATION OF DEHYDROAMINO ACID DERIVATIVES USING RHODIUM AND IRIDIUM DIPHOSPHINITE CARBOHYDRATE CATALYST COMPOSITIONS E.I. DU PONT DE NEMOURS AND COMPANY (US) 1996-10-30 EP disclosed
JP-H07291883-A ETHER COMPOUND AND PERFUME COMPOSITION CONTAINING THE SAME SODA KORYO KK 1995-11-07 JP disclosed
WO-1995018787-A1 SELECTIVE ASYMMETRIC HYDROGENATION OF DEHYDROAMINO ACID DERIVATIVES USING RHODIUM AND IRIDIUM DIPHOSPHINITE CARBOHYDRATE CATALYST COMPOSITIONS E.I. DU PONT DE NEMOURS AND COMPANY (US) 1995-07-13 WO disclosed
EP-0362705-B1 Catalysts for the polymerization of olefins HIMONT INC (US) 1995-01-11 EP disclosed
CN-1090274-A Condensed heterocyclic compounds and its preparation method and application TAKEDA CHEMICAL INDUSTRIES LTD (JP) 1994-08-03 CN disclosed
EP-0393667-B1 PROCESS FOR THE PRODUCTION OF BENZYL METHYL ESTERS BASF Aktiengesellschaft (DE) 1993-06-23 EP disclosed
US-4978648-A Alkyl-aluminum, diether, magnesium dichloride, titanium halide components; propylene polymerization HIMONT INCORPORATED (US) 1990-12-18 US disclosed
EP-0393667-A1 Process for the production of benzyl methyl esters BASF Aktiengesellschaft (DE) 1990-10-24 EP disclosed
EP-0362705-A2 Catalysts for the polymerization of olefins MONTELL NORTH AMERICA INC. (US) 1990-04-11 EP 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 (2 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-20230337672-A1 METHOD OF CONTROLLING SOYBEAN RUST FUNGUS HAVING RESISTANCE TO QoI FUNGICIDE CYC1, SQOR, MT-CO1 IDO1 1021/4885TAAR1 2824/4885CHRM2 2211/4885
US-20230232827-A1 METHOD FOR CONTROLLING SOYBEAN RUST FUNGUS RESISTANT TO QoI FUNGICIDES CYC1, SQOR, MT-CO3 IDO1 1034/4885TAAR1 2330/4885CHRM2 1446/4885

“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.