SCHEMBL112063

SCHEMBL112063

CCCOC(=O)c1ccccc1C(=O)OCCC

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 1.00
TSHR P16473 8/20 0.78
TDP1 Q9NUW8 4/20 0.78
L3MBTL1 Q9Y468 2/20 0.78
CYP3A4 P08684 2/20 0.75
MAPK1 P28482 2/20 0.75
TP53 P04637 1/20 0.75
LMNA P02545 2/20 0.72
HSD17B10 Q99714 4/20 0.61
KDM4E B2RXH2 3/20 0.57
POLB P06746 1/20 0.57
MAOB P27338 1/20 0.55
ESR1 P03372 1/20 0.55
CHRM1 P11229 1/20 0.55
SLC6A2 P23975 1/20 0.55
KDR P35968 1/20 0.55
CA2 P00918 1/20 0.53

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
SCHEMBL19066309 1.00 ALDH1A1 (1.00) ALDH1A1TSHRTDP1L3MBTL1CYP3A4
SCHEMBL888567 0.94 ALDH1A1 (0.89) ALDH1A1TSHRTDP1L3MBTL1CYP3A4
SCHEMBL1554746 0.92 ALDH1A1 (0.85) ALDH1A1TSHRTDP1L3MBTL1CYP3A4
SCHEMBL31589072 0.92 ALDH1A1 (0.85) ALDH1A1TSHRTDP1L3MBTL1CYP3A4
SCHEMBL12976891 0.92 ALDH1A1 (0.85) ALDH1A1TSHRTDP1L3MBTL1CYP3A4
SCHEMBL235931 0.92 ALDH1A1 (0.85) ALDH1A1TSHRTDP1L3MBTL1CYP3A4
SCHEMBL5164954 0.92 ALDH1A1 (0.85) ALDH1A1TSHRTDP1L3MBTL1CYP3A4
Dibutyl Phthalate SCHEMBL9628317 0.92 TSHR (0.93) ALDH1A1TSHRTDP1L3MBTL1CYP3A4
SCHEMBL6057088 0.92 TSHR (0.93) ALDH1A1TSHRTDP1L3MBTL1CYP3A4
SCHEMBL27658326 0.92 ALDH1A1 (0.85) ALDH1A1TSHRTDP1L3MBTL1CYP3A4

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

Appears in 6008 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-122079292-A Method for degrading phthalate pollutants by utilizing light activated periodate 2026-05-26 CN claimed
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
CN-122037003-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-3529300-B1 PLASTICIZED PVC ADMIXTURES WITH SURFACE MODIFYING MACROMOLECULES AND ARTICLES MADE THEREFROM EVONIK CANADA INC (CA) 2026-05-06 EP claimed
US-12325788-B2 Plasticized PVC admixtures with surface modifying macromolecules and articles made therefrom Evonik Canada Inc. (CA) 2025-06-10 US claimed
CN-120060093-A Gordonia for degrading various phthalate esters and application thereof in repairing phthalate ester contaminated soil 廊坊师范学院 2025-05-30 CN 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
WO-2025075986-A9 HYDROGEL ORAL DELIVERY SYSTEMS AND METHODS SCIENTIFIC HORIZONS CONSULTING LLC (US) 2025-05-15 WO claimed
CN-119930872-A Catalyst system, prepolymerized catalyst composition and olefin polymerization process 中国石油化工股份有限公司 2025-05-06 CN claimed
CN-119930869-A Auxiliary agent for olefin polymerization, olefin catalyst system, prepolymerized catalyst composition and olefin polymerization method 中国石油化工股份有限公司 2025-05-06 CN claimed
US-4723965-A PHTHALATE DIESTER ANTIFOULING FUEL ADDITIVES NIPPON OIL CO., LTD. (JP) 1988-02-09 US claimed
US-4715897-A CARBON AND GRAPHITE ELECTRODES UNION CARBIDE CORPORATION (US) 1987-12-29 US 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
EP-0194015-A1 Gasoline compositions NIPPON OIL CO. LTD. (JP) 1986-09-10 EP claimed
US-4568146-A AMORPHOUS POLYMER CORE CONTAINING PLASTICIZER AND CLADDING TO PREVENT CROSS-MIGRATION SUMITOMO ELECTRIC INDUSTRIES, LTD. (JP) 1986-02-04 US claimed
US-4058122-A Osmotic system with laminated wall formed of different materials ALZA CORPORATION (US) 1977-11-15 US claimed
US-4043940-A FREE-RADICAL INITIATORS PENNWALT CORPORATION (US) 1977-08-23 US claimed
US-4014847-A SULFONATED ADDITION POLYMERS EXXON RESEARCH AND ENGINEERING COMPANY (US) 1977-03-29 US claimed
US-3968198-A IODINE ISOCYANATE BRIDGESTONE TIRE COMPANY LIMITED (JA) 1976-07-06 US claimed