SCHEMBL888567

SCHEMBL888567

CCCOC(=O)c1ccccc1C(=O)OCC

nearest known ligand 0.89

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.89
TSHR P16473 7/20 0.81
TDP1 Q9NUW8 2/20 0.70
L3MBTL1 Q9Y468 2/20 0.70
CYP3A4 P08684 2/20 0.68
MAPK1 P28482 2/20 0.68
TP53 P04637 1/20 0.68
LMNA P02545 2/20 0.66
HSD17B10 Q99714 6/20 0.62
CDC25B P30305 1/20 0.57
KDM4E B2RXH2 4/20 0.54
POLB P06746 1/20 0.53
MAOB P27338 1/20 0.51

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 0.94 ALDH1A1 (1.00) ALDH1A1TSHRTDP1L3MBTL1CYP3A4
SCHEMBL112063 0.94 ALDH1A1 (1.00) ALDH1A1TSHRTDP1L3MBTL1CYP3A4
SCHEMBL9877390 0.93 ALDH1A1 (0.77) ALDH1A1TSHRTDP1L3MBTL1CYP3A4
Diethyl Phthalate SCHEMBL22296 0.90 TSHR (1.00) ALDH1A1TSHRTDP1L3MBTL1CYP3A4
Diethyl Phthalate SCHEMBL5306972 0.90 TSHR (1.00) ALDH1A1TSHRTDP1L3MBTL1CYP3A4
Diethyl Phthalate SCHEMBL29404255 0.90 TSHR (1.00) ALDH1A1TSHRTDP1L3MBTL1CYP3A4
Ethyl Salicylate SCHEMBL27816869 0.90 ALDH1A1 (0.71) ALDH1A1TSHRTDP1L3MBTL1CYP3A4
SCHEMBL888276 0.89 TSHR (0.89) ALDH1A1TSHRTDP1L3MBTL1CYP3A4
Dibutyl Phthalate SCHEMBL1532115 0.89 TSHR (0.89) ALDH1A1TSHRTDP1L3MBTL1CYP3A4
Dibutyl Phthalate SCHEMBL30860160 0.89 TSHR (0.89) 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

Claimed or disclosed in 212 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116769083-A Preparation method and device of 1-butene polymer 中国石油化工股份有限公司 2023-09-19 CN claimed
CN-116769095-A 1-butene solution polymerization method and device 中国石油化工股份有限公司 2023-09-19 CN claimed
CN-116769096-A Preparation method of high isotactic polybutene-1 中国石油化工股份有限公司 2023-09-19 CN claimed
CN-116769089-A Preparation process and device of polybutene-1 resin 中国石油化工股份有限公司 2023-09-19 CN claimed
CN-116769091-A Preparation method of polybutene-1 resin 中国石油化工股份有限公司 2023-09-19 CN claimed
CN-116769090-A Preparation method of butene-1 polymer 中国石油化工股份有限公司 2023-09-19 CN claimed
CN-116769088-A Preparation method of high isotactic polybutene-1 中国石油化工股份有限公司 2023-09-19 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
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
JP-61228004-A None JP disclosed
JP-61152707-A None JP disclosed
US-4107150-A High impact terephthalate copolyesters using 1,4-butanediol and 1,4-cyclohexanedimethanol PHILLIPS PETROLEUM COMPANY (US) 1978-08-15 US disclosed
US-4049635-A TRANSESTERIFICATION PHILLIPS PETROLEUM COMPANY (US) 1977-09-20 US disclosed