SCHEMBL3682871

SCHEMBL3682871

CCCCCCCC(CC)C(=O)OCC

nearest known ligand 0.60

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CA2 P00918 7/20 0.60
CA1 P00915 4/20 0.60
CPB2 Q96IY4 2/20 0.54
MAPK1 P28482 1/20 0.50
ZDHHC7 Q9NXF8 1/20 0.47
GRIK1 P39086 1/20 0.44
GRIK2 Q13002 1/20 0.44
GPR84 Q9NQS5 3/20 0.44
FFAR1 O14842 1/20 0.44
MAPT P10636 1/20 0.42

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
SCHEMBL8157817 1.00 CA2 (0.60) CA2CA1CPB2MAPK1ZDHHC7
SCHEMBL2334605 1.00 CA2 (0.60) CA2CA1CPB2MAPK1ZDHHC7
SCHEMBL6518229 1.00 CA2 (0.60) CA2CA1CPB2MAPK1ZDHHC7
SCHEMBL28822842 1.00 CA2 (0.60) CA2CA1CPB2MAPK1ZDHHC7
SCHEMBL3671861 1.00 CA2 (0.60) CA2CA1CPB2MAPK1ZDHHC7
SCHEMBL5046728 1.00 CA2 (0.60) CA2CA1CPB2MAPK1ZDHHC7
SCHEMBL25279786 1.00 CA2 (0.60) CA2CA1CPB2MAPK1ZDHHC7
SCHEMBL28547703 1.00 CA2 (0.60) CA2CA1CPB2MAPK1ZDHHC7
SCHEMBL5049747 1.00 CA2 (0.60) CA2CA1CPB2MAPK1ZDHHC7
Ammonia Solution, Strong SCHEMBL5804627 0.98 CA2 (0.58) CA2CA1CPB2MAPK1ZDHHC7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110279684-B Use of formyl peptide receptor 2 agonists for the treatment of ocular inflammatory diseases 阿勒根公司 2023-02-28 CN claimed
CN-112430632-B Preparation method of 2- ((trans) -4-aminocyclohexyl) isopropanol 上海合全药物研发有限公司 2022-09-13 CN claimed
CN-109661396-B Spiro-fused cyclic ureas as ROCK inhibitors 百时美施贵宝公司 2022-07-01 CN claimed
CN-112430632-A Preparation method of 2- ((trans) -4-aminocyclohexyl) isopropanol 上海合全药物研发有限公司 2021-03-02 CN claimed
CN-105764902-B Spiro-compound as tryptophan hydroxylase inhibitor 卡罗斯制药公司 2019-02-15 CN claimed
CN-112204009-B Modulators of integrated stress pathways 卡里科生命科学有限责任公司 2024-05-07 CN disclosed
CN-117683029-A Bcl-2 inhibitors 百济神州有限公司 2024-03-12 CN disclosed
CN-117580824-A Modulators of integrated stress pathways 卡里科生命科学有限责任公司 2024-02-20 CN disclosed
CN-117466874-A Preparation method of indole-containing polysubstituted tetrahydrofuran compound 扬州大学 2024-01-30 CN disclosed
CN-117430601-A Bcl-2 inhibitors 百济神州有限公司 2024-01-23 CN disclosed
CN-117377675-A Bruton's tyrosine kinase degradation agent containing parallel ring or spiro ring 正大天晴药业集团股份有限公司 2024-01-09 CN disclosed
CN-112204012-B Modulators of integrated stress pathways 卡里科生命科学有限责任公司 2023-12-26 CN disclosed
CN-103547579-B Fused imidazole derivatives as IDO inhibitors 新联基因公司 2017-02-15 CN disclosed
CN-102448955-B Aminopyrimidine Anticancer Compounds OSI PHARM INC 2014-06-18 CN disclosed
CN-102448955-A Aminopyrimidine Anticancer Compounds OSI PHARM INC 2012-05-09 CN disclosed
US-7714087-B2 Polar group-containing olefin copolymer, process for preparing the same, thermoplastic resin composition containing the copolymer, and uses thereof MITSUI CHEMICALS, INC. (JP) 2010-05-11 US disclosed
US-20090137757-A1 Polar group-containing olefin copolymer, process for preparing the same, thermoplastic resin composition containing the copolymer, and uses thereof IMUTA JUNICHI 2009-05-28 US disclosed
EP-1631286-A4 N-UREIDOALKYL-PIPERIDINES AS MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY BRISTOL MYERS SQUIBB CO (US) 2007-08-29 EP disclosed
EP-1631286-A2 N-UREIDOALKYL-PIPERIDINES AS MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY Bristol-Myers Squibb Company (US) 2006-03-08 EP disclosed
WO-2004110993-A2 N-UREIDOALKYL-PIPERIDINES AS MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY BRISTOL-MYERS SQUIBB COMPANY (US) 2004-12-23 WO disclosed