SCHEMBL6322502

SCHEMBL6322502

OCCCC(O)COCC(O)CCCO

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.36
USP2 O75604 1/20 0.35
THRB P10828 1/20 0.35
PTPN1 P18031 1/20 0.33
CYP1A2 P05177 1/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2C19 P33261 1/20 0.31
HTT P42858 1/20 0.30

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
SCHEMBL7116256 0.93 USP2 (0.45) KDM4EUSP2THRBPTPN1CYP3A4
SCHEMBL129740 0.92 KDM4E (0.34) KDM4EUSP2THRBPTPN1CYP1A2
SCHEMBL28238169 0.87 TSHR (0.41) USP2THRBPTPN1CYP1A2CYP3A4
SCHEMBL9407351 0.87 THRB (0.54) KDM4EUSP2THRB
SCHEMBL7545745 0.85 USP2 (0.44) KDM4EUSP2THRBPTPN1CYP3A4
SCHEMBL1783854 0.84 USP2 (0.47) KDM4EUSP2THRBPTPN1CYP3A4
SCHEMBL2139326 0.84 USP2 (0.47) KDM4EUSP2THRBPTPN1CYP3A4
SCHEMBL29049258 0.84 HSD17B10 (0.52) KDM4EUSP2THRBPTPN1CYP1A2
SCHEMBL7936270 0.82 THRB (0.53) KDM4EUSP2THRB
SCHEMBL100311 0.81 USP2 (0.48) KDM4EUSP2THRBCYP1A2CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11959115-B2 Saccharification reaction mixture, saccharification enzyme composition, sugar production method, and ethanol production method NISSAN CHEMICAL CORPORATION (JP) 2024-04-16 US disclosed
CN-116804825-A Composition for forming silicon-containing metal hard mask and pattern forming method 信越化学工业株式会社 2023-09-26 CN disclosed
CN-111458980-B Composition for forming underlayer film of silicon-containing resist and method for forming pattern 信越化学工业株式会社 2023-08-11 CN disclosed
US-11359220-B2 Saccharification reaction mixture, saccharification enzyme composition, sugar production method, and ethanol production method NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2022-06-14 US disclosed
EP-3372697-B1 SACCHARIFICATION REACTION LIQUID, SACCHARIFICATION ENZYME COMPOSITION, PRODUCTION METHOD FOR SUGAR, AND PRODUCTION METHOD FOR ETHANOL NISSAN CHEMICAL CORP (JP) 2021-09-15 EP disclosed
US-20180298412-A1 SACCHARIFICATION REACTION MIXTURE, SACCHARIFICATION ENZYME COMPOSITION, SUGAR PRODUCTION METHOD, AND ETHANOL PRODUCTION METHOD NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2018-10-18 US disclosed
EP-3372697-A1 SACCHARIFICATION REACTION LIQUID, SACCHARIFICATION ENZYME COMPOSITION, PRODUCTION METHOD FOR SUGAR, AND PRODUCTION METHOD FOR ETHANOL Nissan Chemical Industries, Ltd. (JP) 2018-09-12 EP disclosed
US-9624356-B2 Ultraviolet absorber, composition for forming a resist under layer film, and patterning process SHIN-ETSU CHEMIAL CO., LTD (JP) 2017-04-18 US disclosed
US-9522979-B2 Fluorine-containing silicon compound, method for producing same, and method for producing fluorine-containing silicon resin SHIN-ETSU CHEMICAL CO., LTD. (JP) 2016-12-20 US disclosed
US-20160229960-A1 FLUORINE-CONTAINING SILICON COMPOUND, METHOD FOR PRODUCING SAME, AND METHOD FOR PRODUCING FLUORINE-CONTAINING SILICON RESIN SHIN-ETSU CHEMICAL CO., LTD. (JP) 2016-08-11 US disclosed
CN-1656157-A Foamed supramolecular polymers HUNTSMAN INT LLC (US) 2005-08-17 CN disclosed
US-6903044-B2 One-step production of 1,3-propanediol from ethylene oxide and syngas with a catalyst with a N-heterocyclic ligand SHELL OIL COMPANY (US) 2005-06-07 US disclosed
CN-1551801-A One-step production of 1,3-propanediol from ethylene oxide and syngas with a catalyst with a N-heterocyclic ligand ���ʿ����о����޹�˾ 2004-12-01 CN disclosed
EP-1395363-A2 ONE-STEP PRODUCTION OF 1,3-PROPANEDIOL FROM ETHYLENE OXIDE AND SYNGAS WITH A CATALYST WITH A N-HETEROCYCLIC LIGAND SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 2004-03-10 EP disclosed
CN-1479759-A Supramolecular polymer forming polymer 2004-03-03 CN disclosed
US-20030204118-A1 One-step production of 1,3-propanediol from ethylene oxide and syngas with a catalyst with a N-heterocyclic ligand KNIFTON JOHN FREDERICK (US) 2003-10-30 US disclosed
CN-1444615-A Diphenylmethane diisocyanate compositions HUNTSMAN INT LLC (US) 2003-09-24 CN disclosed
US-6586643-B2 Heating under pressure mixture of ethylene oxide, carbon monoxide, hydrogen, inert reaction solvent, and catalyst composition comprising non-ligated cobalt carbonyl compound and N-heterocyclic-ligated ruthenium carbonyl compound SHELL OIL COMPANY 2003-07-01 US disclosed
US-20030060668-A1 One-step production of 1, 3-propanediol from ethylene oxide and syngas with a catalyst with a N-heterocyclic ligand SHELL OIL COMPANY 2003-03-27 US disclosed
WO-2002094425-A2 ONE-STEP PRODUCTION OF 1,3-PROPANEDIOL FROM ETHYLENE OXIDE AND SYNGAS WITH A CATALYST WITH A N-HETEROCYCLIC LIGAND SHELL INTERNATIONALE RESEARCH MAATSCHAPPIJ B.V. (NL) 2002-11-28 WO 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 (3 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-20030060668-A1 One-step production of 1, 3-propanediol from ethylene oxide and syngas with a catalyst with a N-heterocyclic ligand SCO2, CYP2U1, CORO1A KDM4E 3518/4885USP2 1836/4885THRB 2043/4885
US-20030204118-A1 One-step production of 1,3-propanediol from ethylene oxide and syngas with a catalyst with a N-heterocyclic ligand SCO2, DUOX1, SYNGR2 KDM4E 2870/4885USP2 1640/4885THRB 3003/4885
US-20160229960-A1 FLUORINE-CONTAINING SILICON COMPOUND, METHOD FOR PRODUCING SAME, AND METHOD FOR PRODUCING FLUORINE-CONTAINING SILICON RESIN RFT1, FEM1B, RER1 KDM4E 1577/4885USP2 2145/4885THRB 4103/4885

“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.