SCHEMBL7540146

SCHEMBL7540146

CCCCCOC(=O)c1ccccc1C(=O)OCC

nearest known ligand 0.90

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 7/20 0.90
MAPK1 P28482 3/20 0.90
CYP3A4 P08684 3/20 0.90
TP53 P04637 1/20 0.90
ALDH1A1 P00352 9/20 0.87
LMNA P02545 3/20 0.87
TDP1 Q9NUW8 3/20 0.80
L3MBTL1 Q9Y468 3/20 0.80
HSD17B10 Q99714 3/20 0.69
KDM4E B2RXH2 3/20 0.69
POLB P06746 1/20 0.69
MAPT P10636 2/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
PRSS1 P07477 1/20 0.54
PRSS2 P07478 1/20 0.54
PRSS3 P35030 1/20 0.54
CA2 P00918 1/20 0.53
CDC25B P30305 1/20 0.53
NPC1 O15118 1/20 0.51
RAB9A P51151 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
SCHEMBL6400444 0.98 ALDH1A1 (0.90) TSHRMAPK1CYP3A4TP53ALDH1A1
SCHEMBL6406718 0.98 ALDH1A1 (0.90) TSHRMAPK1CYP3A4TP53ALDH1A1
SCHEMBL6407094 0.98 ALDH1A1 (0.90) TSHRMAPK1CYP3A4TP53ALDH1A1
SCHEMBL6404715 0.98 ALDH1A1 (0.90) TSHRMAPK1CYP3A4TP53ALDH1A1
SCHEMBL6400469 0.98 ALDH1A1 (0.90) TSHRMAPK1CYP3A4TP53ALDH1A1
SCHEMBL6402186 0.98 ALDH1A1 (0.90) TSHRMAPK1CYP3A4TP53ALDH1A1
SCHEMBL782238 0.98 ALDH1A1 (0.90) TSHRMAPK1CYP3A4TP53ALDH1A1
SCHEMBL6402293 0.98 ALDH1A1 (0.90) TSHRMAPK1CYP3A4TP53ALDH1A1
SCHEMBL6400389 0.98 ALDH1A1 (0.90) TSHRMAPK1CYP3A4TP53ALDH1A1
Diethyl Phthalate SCHEMBL8500108 0.98 ALDH1A1 (0.90) TSHRMAPK1CYP3A4TP53ALDH1A1

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 18 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-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-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-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-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-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-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
US-20240218087-A1 SOLID CATALYST COMPONENT FOR POLYMERIZATION OF OLEFIN, CATALYST FOR POLYMERIZATION OF OLEFIN, METHOD FOR PRODUCING POLYMER OF OLEFIN, POLYMER OF OLEFIN, METHOD FOR PRODUCING PROPYLENE-BASED BLOCK COPOLYMER, AND PROPYLENE-BASED BLOCK COPOLYMER TOHO TITANIUM CO., LTD. (JP) 2024-07-04 US disclosed
CN-117425682-A Solid catalyst component for olefin polymerization, catalyst for olefin polymerization, process for producing olefin polymer, process for producing propylene block copolymer, and propylene block copolymer 东邦钛株式会社 2024-01-19 CN disclosed
CN-115867395-A Method for producing Mg-containing particles 东邦钛株式会社 2023-03-28 CN disclosed
CN-104822712-A Solid catalyst component for polymerizing olefin, catalyst for polymerizing olefin, and method for producing polymerized olefin TOHO TITANIUM CO LTD 2015-08-05 CN disclosed
EP-0861882-B1 Fuel oil composition for diesel engines TONEN CORP (JP) 2002-05-29 EP disclosed
EP-0773240-B1 Solid catalyst component for polymerizing olefins and catalyst for polymerization of olefins TOHO TITANIUM CO LTD (JP) 2001-08-22 EP disclosed
US-5863303-A Fuel oil composition for diesel engines EXXON RESEARCH AND ENGINEERING COMPANY (US) 1999-01-26 US disclosed
EP-0861882-A1 Fuel oil composition for diesel engines TONEN CORPORATION (JP) 1998-09-02 EP disclosed
EP-0773241-A2 Solid catalyst component for polymerizing olefins and catalyst for polymerization of olefins TOHO TITANIUM CO., LTD. (JP) 1997-05-14 EP disclosed
EP-0773240-A2 Solid catalyst component for polymerizing olefins and catalyst for polymerization of olefins TOHO TITANIUM CO., LTD. (JP) 1997-05-14 EP disclosed
EP-0665243-A2 Catalyst for polymerization of olefins and process for polymerization of olefins using the same TOHO TITANIUM CO., LTD. (JP) 1995-08-02 EP disclosed