SCHEMBL4254045

SCHEMBL4254045

CC1C(=O)CCCC1(C)C

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA4 P22748 1/20 0.39
KMT2A Q03164 1/20 0.38
CYP19A1 P11511 2/20 0.33
POLB P06746 1/20 0.31
CYP3A4 P08684 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
SCHEMBL25137147 1.00 CA1 (0.39) CA1CA2CA4KMT2ACYP19A1
SCHEMBL7751334 0.85
SCHEMBL11834684 0.76 TRIM24 (0.36) CA1CA2CA4KMT2A
SCHEMBL31389834 0.74 CA1 (0.33) CA1CA2CA4KMT2ACYP19A1
SCHEMBL17609884 0.74 CA1 (0.33) CA1CA2CA4KMT2ACYP19A1
SCHEMBL5508876 0.74 CA1 (0.34) CA1CA2CA4KMT2ACYP19A1
SCHEMBL22771105 0.73
SCHEMBL22462367 0.73
SCHEMBL11845172 0.73 KMT2A (0.37) CA1CA2CA4KMT2A
SCHEMBL755775 0.71 TRPA1 (0.42) CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114315541-B Cyclohexanone composition and application thereof 万华化学(四川)有限公司 2024-06-25 CN claimed
CN-115160127-B Method for preparing long carbon chain dibasic acid through co-oxidation reaction 中国天辰工程有限公司 2024-06-11 CN claimed
CN-115286497-B Preparation method of 3, 5-trimethylcyclohexanone 中国天辰工程有限公司 2024-04-16 CN claimed
CN-117820092-A Method for preparing 4-oxo-isophorone from beta-isophorone 万华化学集团股份有限公司 2024-04-05 CN claimed
CN-117801253-A Polycarbonate composition and preparation method and application thereof 万华化学集团股份有限公司 2024-04-02 CN claimed
CN-117303995-A Method for preparing high-tension quaternary cycloalkane fuel by cyclic ketone or cyclic alcohol one-pot method and application of fuel 西北工业大学重庆科创中心 2023-12-29 CN claimed
CN-117101726-A Metal complex catalyst and preparation method of 2, 4-trimethyl adipic acid 山东新和成维生素有限公司 2023-11-24 CN claimed
CN-113454064-B Method for producing organic peroxides 诺力昂化学品国际有限公司 2023-10-03 CN claimed
CN-116574528-A Annular high-density biomass liquid fuel and preparation method and application thereof 陕西理工大学 2023-08-11 CN claimed
CN-116425641-A N- (3, 5-trimethyl cyclohexyl) -N' -phenyl p-phenylenediamine and synthesis method thereof 圣奥化学科技有限公司 2023-07-14 CN claimed
EP-2763956-B1 PROCESSES FOR PRODUCING ACRYLIC ACIDS AND ACRYLATES CELANESE INT CORP (US) 2017-03-08 EP claimed
CN-103842328-B Produce the method for vinylformic acid and acrylate CELANESE INTERNATIONAL CORP. (US) 2016-01-20 CN claimed
CN-102718641-B Method for preparing 3,3,5-trimethyl-cyclohexanone by selectively hydrogenating isophorone UNIV BEIJING CHEMICAL 2014-08-13 CN claimed
CN-103842328-A Processes for producing acrylic acids and acrylates CELANESE INT CORP 2014-06-04 CN claimed
CN-102850249-A Preparation method of 1, 1-bis(t-butyl peroxy)-3, 3, 5-trimethylcyclohexane JIANGSU CHINASUN SPECIALTY PRODUCTS CO LTD 2013-01-02 CN claimed
US-8270145-B2 Screen-printable encapsulants based on soluble polybenzoxazoles CDA PROCESSING LIMITED LIABILITY COMPANY (US) 2012-09-18 US claimed
CN-101535388-B Tyre for vehicle wheels comprising a crosslinked elastomeric composition PIRELLI 2012-05-30 CN claimed
CN-1942549-A Aqueous coating composition for flexible substrates DEGUSSA (DE) 2007-04-04 CN claimed
CN-1878812-A Aqueous, radiation-hardenable resins, method for the production thereof, and use of the same DEGUSSA (DE) 2006-12-13 CN claimed
CN-1875076-A Utilization of radiohardenable resins based on hydrogenated ketone and phenol aldehyde resins DEGUSSA (DE) 2006-12-06 CN claimed