SCHEMBL750714

SCHEMBL750714

CCCc1c(C(=O)O)ccc(C(=O)O)c1CCC

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.46
GABRP O00591 2/20 0.44
GABRD O14764 2/20 0.44
GABRA1 P14867 2/20 0.44
GABRB1 P18505 2/20 0.44
GABRG2 P18507 2/20 0.44
GABRB3 P28472 2/20 0.44
GABRA5 P31644 2/20 0.44
GABRA3 P34903 2/20 0.44
GABRA2 P47869 2/20 0.44
GABRB2 P47870 2/20 0.44
GABRA4 P48169 2/20 0.44
GABRE P78334 2/20 0.44
GABRA6 Q16445 2/20 0.44
GABRG1 Q8N1C3 2/20 0.44
GABRG3 Q99928 2/20 0.44
GABRQ Q9UN88 2/20 0.44
PPARA Q07869 2/20 0.44
MCL1 Q07820 1/20 0.44
KDM4E B2RXH2 1/20 0.43

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
SCHEMBL28692384 0.90 MCL1 (0.50) PPARAMCL1LDHALDHBKAT8
SCHEMBL29789878 0.90 MCL1 (0.50) PPARAMCL1LDHALDHBKAT8
SCHEMBL1832618 0.88 MAPT (0.39) CYP1A2GABRPGABRDGABRA1GABRB1
SCHEMBL32680310 0.87 LDHA (0.41) CYP1A2GABRPGABRDGABRA1GABRB1
SCHEMBL28732290 0.87 PPARA (0.41) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL28382 0.86 GABRP (0.54) CYP1A2GABRPGABRDGABRA1GABRB1
SCHEMBL3391070 0.86 ALDH1A1 (0.48) MCL1KDM4ECA12CA9
SCHEMBL3719445 0.85 PPARA (0.57) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL40220 0.84 SELL (0.53) PPARAMCL1LDHALDHBKAT8
SCHEMBL6443257 0.83 PPARA (0.60) PPARAMCL1PPARGKAT8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2481760-B1 INITIATOR SYSTEM FOR CATIONIC POLYMERIZATION AND POLYMERIZATION METHOD USING SAME CHINA PETROLEUM & CHEM CORP (CN) 2021-05-05 EP claimed
EP-3452542-B1 COMPOSITION FOR HYDROLYTIC STABILIZATION OF POLYESTER CLARIANT PLASTICS & COATINGS LTD (CH) 2021-02-24 EP claimed
US-10808101-B2 Composition for hydrolytic stabilization of polyester CLARIANT PLASTICS & COATINGS LTD (CH) 2020-10-20 US claimed
US-20190153195-A1 Composition For Hydrolytic Stabilization Of Polyester CLARIANT PLASTICS & COATINGS LTD (CH) 2019-05-23 US claimed
EP-3452542-A1 COMPOSITION FOR HYDROLYTIC STABILIZATION OF POLYESTER Clariant Plastics & Coatings Ltd (CH) 2019-03-13 EP claimed
WO-2017190993-A1 COMPOSITION FOR HYDROLYTIC STABILIZATION OF POLYESTER CLARIANT PLASTICS & COATINGS LTD (CH) 2017-11-09 WO claimed
EP-3241866-A1 COMPOSITION FOR POLYESTER HYDROLYTIC STABILIZATION Clariant Plastics & Coatings Ltd (CH) 2017-11-08 EP claimed
EP-1567470-B1 HYDROGENATION OF BENZENE POLYCARBOXYLIC ACIDS OR DERIVATIVES THEREOF EXXONMOBIL CHEM PATENTS INC (US) 2013-06-05 EP claimed
EP-1208124-B1 LIQUID COMPOSITION POLYMERIZABLE INTO ORGANIC GLASS HAVING GOOD OPTICAL AND PHYSICO-MECHANICAL PROPERTIES GREAT LAKES CHEMICAL EUROP (CH) 2004-10-27 EP claimed
US-5449719-A Two-step processes for the preparation of unsaturated polyesters XEROX CORPORATION (US) 1995-09-12 US claimed
US-4562173-A MAGNESIUM FATTY ACID SALT, MAGNESIUM CARBONATE COMPOUND, AROMATIC DICARBOXYLIC ACID ESTER, TITANIUM HALIDE, SILICON COMPOUND, ORGANOA TOHO TITANIUM CO., LTD. (JP) 1985-12-31 US claimed
US-4547476-A COORDINATION CATALYST CONTAINING MAGNESIUM, TITANIUM, ALUMINUM ANDSILICON COMPOUNDS, AROMATIC ESTER AND HALOGENATED COMPOUNDS TOHO TITANIUM CO., LTD. (JP) 1985-10-15 US claimed
EP-3183757-B1 ORGANIC SEMICONDUCTOR COMPOSITION COMPRISING LIQUID MEDIUM CLAP CO LTD (KR) 2022-05-04 EP disclosed
US-11155675-B2 Method of regioselective synthesis of polyesters from asymmetric diols VERSALIS S.P.A. (IT) 2021-10-26 US disclosed
US-10808101-B2 Composition for hydrolytic stabilization of polyester CLARIANT PLASTICS & COATINGS LTD (CH) 2020-10-20 US disclosed
EP-3491044-B1 METHOD OF REGIOSELECTIVE SYNTHESIS OF POLYESTERS FROM ASYMMETRIC DIOLS VERSALIS SPA (IT) 2020-08-26 EP disclosed
EP-0442101-B1 Polyesters containing nonionic surfactants in a condensed form, their preparation and their use in detergents BASF AG (DE) 1995-04-12 EP disclosed
EP-0442101-A1 Polyesters containing nonionic surfactants in a condensed form, their preparation and their use in detergents BASF Aktiengesellschaft (DE) 1991-08-21 EP disclosed
US-4562173-A MAGNESIUM FATTY ACID SALT, MAGNESIUM CARBONATE COMPOUND, AROMATIC DICARBOXYLIC ACID ESTER, TITANIUM HALIDE, SILICON COMPOUND, ORGANOA TOHO TITANIUM CO., LTD. (JP) 1985-12-31 US disclosed
US-4547476-A COORDINATION CATALYST CONTAINING MAGNESIUM, TITANIUM, ALUMINUM ANDSILICON COMPOUNDS, AROMATIC ESTER AND HALOGENATED COMPOUNDS TOHO TITANIUM CO., LTD. (JP) 1985-10-15 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 (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-10808101-B2 Composition for hydrolytic stabilization of polyester C1R, CEL, CMA1 CYP1A2 133/4885GABRP 4646/4885GABRD 4539/4885
US-20190153195-A1 Composition For Hydrolytic Stabilization Of Polyester C1R, CEL, CMA1 CYP1A2 133/4885GABRP 4646/4885GABRD 4539/4885

“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.