SCHEMBL1743388

SCHEMBL1743388

CC(C)CCOOCCC(C)C

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.48
CA1 P00915 2/20 0.42
CA12 O43570 1/20 0.42
CA2 P00918 1/20 0.42
CA9 Q16790 1/20 0.42
TDP1 Q9NUW8 2/20 0.37
LMNA P02545 1/20 0.35
HTT P42858 1/20 0.33
MAPK1 P28482 1/20 0.32
PIK3CD O00329 1/20 0.32
ESR1 P03372 1/20 0.31
EPHX2 P34913 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
SCHEMBL28291120 0.96 ALDH1A1 (0.46) ALDH1A1CA1CA12CA2CA9
SCHEMBL27499755 0.83
SCHEMBL30589896 0.83 LMNA (0.43) ALDH1A1CA1CA12CA2CA9
SCHEMBL10039218 0.81
SCHEMBL6335898 0.81 OPRM1 (0.39) ALDH1A1CA1CA12CA2CA9
SCHEMBL10604001 0.79 LMNA (0.45) ALDH1A1CA1CA12CA2CA9
SCHEMBL5665308 0.79 DNM1 (0.39) CA1CA2CA9HTT
SCHEMBL29116793 0.79 ALDH1A1 (0.34) ALDH1A1CA1CA12CA2CA9
SCHEMBL42956 0.77 ALDH1A1 (0.48) ALDH1A1CA1CA12CA2CA9
SCHEMBL12820982 0.76

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118374261-A Efficient and fast-curing multifunctional adhesive and preparation process thereof 无锡市百合花胶粘剂厂有限公司 2024-07-23 CN claimed
CN-114127045-B Method for producing diacyl peroxide 诺力昂化学品国际有限公司 2023-10-13 CN claimed
CN-118374261-A Efficient and fast-curing multifunctional adhesive and preparation process thereof 无锡市百合花胶粘剂厂有限公司 2024-07-23 CN disclosed
CN-115922861-B Composition for wood impregnation, wood prepreg, modified wood, and method for producing same 北京化工大学 2024-03-26 CN disclosed
CN-114127045-B Method for producing diacyl peroxide 诺力昂化学品国际有限公司 2023-10-13 CN disclosed
CN-115922861-A Composition for wood impregnation, wood prepreg, modified wood, and method for producing same 北京化工大学 2023-04-07 CN disclosed
CN-114276479-A Preparation method of carboxyl-terminated liquid rubber 天元(杭州)新材料科技有限公司 2022-04-05 CN disclosed
CN-106191106-B VvSUC27 gene is promoting the application in the extraneous sucrose of plant intake 中国农业大学 2019-10-18 CN disclosed
CN-106727943-A One kind treats phthisical pharmaceutical composition and preparation method thereof 济南昊雨青田医药技术有限公司 2017-05-31 CN disclosed
CN-103459542-B Binder composition comprising tannin, polyethylene glycol and water, lower alcohol or mixture thereof 韩国科学技术院 2017-05-17 CN disclosed
WO-2011144273-A1 BIOCIDE COMPOSITIONS COMPRISING ISOAMYL LACTATE COGNIS IP MANAGEMENT GMBH (DE) 2011-11-24 WO disclosed
CN-101308340-B Toner preparation method and apparatus, and toner prepared thereby RICOH CO LTD 2011-07-27 CN disclosed
CN-101308338-B Toner preparation method and apparatus, and toner prepared thereby RICOH CO LTD 2011-03-09 CN disclosed
CN-101308338-A Toner preparation method and apparatus, and toner prepared thereby RICOH KK (JP) 2008-11-19 CN disclosed
CN-101308340-A Toner preparation method and apparatus, and toner prepared thereby RICOH KK (JP) 2008-11-19 CN disclosed
US-20050288532-A1 Oxidation method BASF AKTIENGESELLSCHAFT (DE) 2005-12-29 US disclosed
EP-1536885-A1 OXIDATION METHOD BASF AKTIENGESELLSCHAFT (DE) 2005-06-08 EP disclosed
WO-2004020083-A1 OXIDATION METHOD BASF AKTIENGESELLSCHAFT (DE) 2004-03-11 WO disclosed
US-4120862-A Use of copper halide catalysts and certain epoxy compounds to oxidize nitro-substituted Schiff bases to benzoxazoles THE DOW CHEMICAL COMPANY (US) 1978-10-17 US disclosed
US-4065511-A REACTING ORGANIC PEROXIDES AND A TRIHYDROCARBYL PHOSPHINE PHILLIPS PETROLEUM (US) 1977-12-27 US disclosed