SCHEMBL204946

SCHEMBL204946

CC(C)CCOC(=O)c1ccccc1C(=O)OCCC(C)C

nearest known ligand 0.67

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 6/20 0.67
ALDH1A1 P00352 6/20 0.67
TDP1 Q9NUW8 2/20 0.59
L3MBTL1 Q9Y468 1/20 0.59
MAPK1 P28482 2/20 0.58
CYP3A4 P08684 2/20 0.58
TP53 P04637 1/20 0.58
LMNA P02545 1/20 0.56
HTT P42858 1/20 0.54
HSD17B10 Q99714 2/20 0.51
PKM P14618 2/20 0.51
KDM4E B2RXH2 2/20 0.49
PPARG P37231 1/20 0.49
CA2 P00918 1/20 0.49
GAA P10253 1/20 0.49
KMT2A Q03164 1/20 0.49

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
SCHEMBL29754649 1.00 TSHR (0.67) TSHRALDH1A1TDP1L3MBTL1MAPK1
SCHEMBL7059436 0.93 ALDH1A1 (0.59) TSHRALDH1A1TDP1L3MBTL1MAPK1
SCHEMBL27189850 0.93 TSHR (0.70) TSHRALDH1A1TDP1L3MBTL1MAPK1
SCHEMBL7805586 0.93 ALDH1A1 (0.77) TSHRALDH1A1TDP1L3MBTL1MAPK1
SCHEMBL27784225 0.93 TSHR (0.80) TSHRALDH1A1TDP1L3MBTL1MAPK1
SCHEMBL3014742 0.93 TSHR (0.62) TSHRALDH1A1TDP1L3MBTL1MAPK1
Ethane SCHEMBL28902205 0.92 ALDH1A1 (0.57) TSHRALDH1A1TDP1L3MBTL1MAPK1
SCHEMBL16044450 0.90 TSHR (0.56) TSHRALDH1A1TDP1L3MBTL1MAPK1
SCHEMBL29449291 0.90 TDP1 (0.67) TSHRALDH1A1TDP1L3MBTL1MAPK1
SCHEMBL113328 0.90 TDP1 (0.67) TSHRALDH1A1TDP1L3MBTL1MAPK1

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 1113 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-122037002-A Catalyst component for olefin polymerization, catalyst and application thereof, and olefin polymerization method 中国石油化工股份有限公司 2026-05-15 CN claimed
EP-4619461-A1 METHOD FOR EXTRACTION AND TRANSFORMATION BY HYDROLYSIS OF PHTHALATES CONTAINED IN PVC PLASTICS IFP Energies nouvelles (FR) 2025-09-24 EP claimed
EP-4619462-A1 METHOD FOR THE EXTRACTION AND TRANSFORMATION, BY ALCOHOLYSIS AND HYDROLYSIS, OF PHTHALATES CONTAINED IN PVC PLASTICS IFP Energies nouvelles (FR) 2025-09-24 EP claimed
CN-112639458-B Mass spectrometer, and evaluation and correction method, analysis method, and reagent therefor 株式会社岛津制作所 2025-05-27 CN claimed
US-20250115686-A1 OLEFIN POLYMERIZATION CATALYST COMPONENTS CONTAINING SILANE AND PROCESS FOR THE PRODUCTION OF POLYPROPYLENE HAVING HIGH ISOTACTICITY AT HIGH MELT FLOW RATE FORMOSA PLASTICS CORP USA (US) 2025-04-10 US claimed
US-12270796-B2 Detection method, analysis method, analysis device and non-transitory computer readable medium SHIMADZU CORPORATION (JP) 2025-04-08 US claimed
US-12266517-B2 Method for evaluating mass spectrometry device, method for calibrating mass spectrometry device, analysis method, mass spectrometry device, and mass spectrometry reagent SHIMADZU CORPORATION (JP) 2025-04-01 US claimed
US-20250075051-A1 PROCESS FOR RECYCLING CONTAMINATED POLYMERS ARKEMA FRANCE (FR) 2025-03-06 US claimed
US-20250066514-A1 CATALYSTS COMPONENT AND PROCESS FOR THE PRODUCTION OF POLYPROPYLENE HAVING HIGH MELT FLOW RATE WITH HIGH ISOTACTICITY FORMOSA PLASTICS CORP USA (US) 2025-02-27 US claimed
CN-119462310-A Fusion casting type low-cost thermoplastic solid propellant and preparation method thereof 中北大学 2025-02-18 CN claimed
EP-0297163-B2 A solid catalyst component for the polymerization of olefins and an olefin polymerization catalyst TOHO TITANIUM CO LTD (JP) 2000-08-23 EP claimed
EP-0263516-B1 A SOLID CATALYST COMPONENT FOR OLEFIN POLYMERIZATION CATALYSTS TOHO TITANIUM CO. LTD. (JP) 1992-04-22 EP claimed
CN-1054253-A Copolymer latex of vinyl acetate and cis (trans) butenedioic acid diisoamyl alcohol ester INST OF YUEYANG PETRO CHEMICAL (CN) 1991-09-04 CN claimed
US-4847227-A COORDINATION CATALYSTS, DIETHOXYMAGNESIUM, TITANIUM TETRACHLORIDE, DIESTERS OF AROMATICDICARBOXYLIC ACIDS AND CALCIUM CHLORIDE TOHO TITANIUM CO., LTD. (JP) 1989-07-11 US claimed
US-4839321-A COORDINATION CATALYST CONTAINING DIETHOXY MAGNESIUM, CALCIUM CHLORIDE, SILICON COMPOUND, TITANIUM TETRACHLORIDE, AROMATIC DIESTER, AND ORGANOALUMINUM COMPOUND TOHO TITANIUM CO., LTD. (JP) 1989-06-13 US claimed
US-4816433-A COORDINATION CATALYSTS OF TITANIUM TETRACHLORIDE, PHTHALIC DIESTERS, SILANE COMPOUNDS TOHO TITANIUM CO., LTD. (JP) 1989-03-28 US claimed
EP-0297163-A1 A solid catalyst component for the polymerization of olefins and an olefin polymerization catalyst TOHO TITANIUM CO. LTD. (JP) 1989-01-04 EP claimed
EP-0263516-A2 A solid catalyst component for olefin polymerization catalysts TOHO TITANIUM CO. LTD. (JP) 1988-04-13 EP claimed
US-4686200-A Catalyst for the polymerization of olefins TOHO TITANIUM CO., LTD. (JP) 1987-08-11 US claimed
US-4640906-A ORGANOALUMINUM COMPOUND, PIPERIDINE DERIVATIVE AND SOLID FROM DIALKOXYMAGNESIUM COMPOUND, AROMATIC DIESTER AND HALOGENATED HYDROCARBON TOHO TITANIUM CO., LTD. (JP) 1987-02-03 US claimed