SCHEMBL23929064

SCHEMBL23929064

O=C1OCCOC(=O)c2ccc1cc2.OCC1CCC(CO)CC1

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ ESR2 Q92731 7/20 0.39
▸ ESR1 P03372 6/20 0.39
▸ CYP3A4 P08684 2/20 0.39
▸ CYP2C9 P11712 2/20 0.39
▸ CYP2D6 P10635 2/20 0.35
▸ CHRM2 P08172 1/20 0.34
▸ CHRM1 P11229 1/20 0.34
▸ CHRM3 P20309 1/20 0.34
▸ PARP1 P09874 1/20 0.32
▸ PARP2 Q9UGN5 1/20 0.32
▸ OXTR P30559 1/20 0.31
▸ PARP14 Q460N5 1/20 0.31
▸ LTA4H P09960 2/20 0.31
▸ LRRK2 Q5S007 1/20 0.31
▸ GSK3B P49841 1/20 0.30
▸ DYRK1A Q13627 1/20 0.30
▸ ALOX5 P09917 1/20 0.30

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
Terephthalic Acid SCHEMBL29013595 0.89 PTGES (0.38) OXTRALOX5
SCHEMBL28949035 0.81 TDP1 (0.34) LTA4H
Ethylene Glycol SCHEMBL83460 0.81 ITGB2 (0.35) GSK3BALOX5
SCHEMBL22419 0.78 ITGB2 (0.43) DYRK1A
SCHEMBL17628649 0.78 ITGB2 (0.43) DYRK1A
SCHEMBL3874923 0.78 ITGB2 (0.43) DYRK1A
1,4-Butanediol SCHEMBL28279001 0.78 KDM4E (0.34) GSK3B
SCHEMBL21436797 0.76 ITGB2 (0.41) DYRK1A
SCHEMBL29958439 0.76 ITGB2 (0.41) DYRK1A
SCHEMBL9706415 0.76 ITGB2 (0.41) DYRK1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115771323-A Antibacterial heat-sealable bidirectional stretched polylactic acid film and preparation method thereof 厦门长塑实业有限公司 2023-03-10 — — CN claimed
CN-118085361-B Preparation method of modified regenerated PETG polyester film 河南银金达彩印股份有限公司 2024-07-09 — — CN disclosed
CN-118082028-A Method for recycling waste mixed multilayer composite waste plastic film 河南银金达彩印股份有限公司 2024-05-28 — — CN disclosed
CN-118085361-A Preparation method of modified regenerated PETG polyester film 河南银金达彩印股份有限公司 2024-05-28 — — CN disclosed
CN-115991889-A Polycarbonate article processing method 科思创德国股份有限公司 2023-04-21 — — CN disclosed
CN-115181417-A Method for preparing high-strength 3D printing polymer wire by taking pyrophyllite powder as filler 浙江皓翔矿业有限公司 2022-10-14 — — CN disclosed
CN-115074070-A Polyester structural adhesive and preparation method and application thereof 苏州瀚海新材料有限公司 2022-09-20 — — CN disclosed
WO-2021212538-A1 RADIATION REFRIGERATION METAL PLATE, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF 宁波瑞凌新能源科技有限公司 (CN) 2021-10-28 — — WO disclosed
CN-213122342-U Full-spectrum reflective film 宁波瑞凌新能源科技有限公司 2021-05-04 — — CN disclosed
CN-212242530-U Double-layer coated PVC wood-plastic section and special equipment 吉林庭然景观材料科技有限公司 2020-12-29 — — CN disclosed
CN-111978688-A APET composite material and preparation method thereof, keyboard cover, electronic component tray and preparation method thereof 深圳市品兴隆塑胶制品有限公司 2020-11-24 — — CN disclosed
CN-111736246-A Full-spectrum reflective film 宁波瑞凌新能源科技有限公司 2020-10-02 — — CN disclosed
CN-111439015-A Double-layer coated PVC wood-plastic profile and preparation method thereof 吉林庭然景观材料科技有限公司 2020-07-24 — — CN disclosed
CN-210820959-U Film pressing production line 苏州铼赛智能科技有限公司 2020-06-23 — — CN disclosed
CN-106018005-B Sampling tube for detecting carbonyl compounds in atomized steam of electronic cigarette and preparation method and application thereof 深圳瀚星翔科技有限公司 2019-12-13 — — CN disclosed
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