SCHEMBL1725609

SCHEMBL1725609

CCCCCCCCC(CC)C(=O)OC(C)(C)C

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CA2 P00918 7/20 0.56
CA1 P00915 4/20 0.56
MAPK1 P28482 1/20 0.47
ZDHHC7 Q9NXF8 1/20 0.44
GAA P10253 1/20 0.43
XBP1 P17861 1/20 0.43
ATM Q13315 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
GRIK1 P39086 1/20 0.42
GRIK2 Q13002 1/20 0.42
SMPD1 P17405 3/20 0.42
GPR84 Q9NQS5 3/20 0.41
FFAR1 O14842 1/20 0.41
MAPT P10636 1/20 0.40

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
SCHEMBL28491401 1.00 CA2 (0.56) CA2CA1MAPK1ZDHHC7GAA
SCHEMBL28497772 1.00 CA2 (0.56) CA2CA1MAPK1ZDHHC7GAA
SCHEMBL585232 1.00 CA2 (0.56) CA2CA1MAPK1ZDHHC7GAA
SCHEMBL190801 1.00 CA2 (0.56) CA2CA1MAPK1ZDHHC7GAA
Hydrochloric Acid SCHEMBL27586576 0.98 CA2 (0.55) CA2CA1MAPK1ZDHHC7GAA
Hydrochloric Acid SCHEMBL27649377 0.98 CA2 (0.55) CA2CA1MAPK1ZDHHC7GAA
Hydrochloric Acid SCHEMBL27649378 0.98 CA2 (0.55) CA2CA1MAPK1ZDHHC7GAA
Ethane SCHEMBL28789613 0.98 CA2 (0.55) CA2CA1MAPK1ZDHHC7GAA
SCHEMBL3836421 0.98 CA2 (0.58) CA2CA1MAPK1ZDHHC7GAA
Oxalic Acid SCHEMBL28618643 0.95 CA2 (0.51) CA2CA1MAPK1ZDHHC7GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113135921-A Dihydropyrimidine-spiro derivative and preparation method and application thereof 山东大学 2021-07-20 CN claimed
CN-107873023-A 3-alkyl-4-amido-bicyclo [4, 5, 0] hydroxamic acids as HDAC inhibitors 福马治疗股份有限公司 2018-04-03 CN claimed
CN-104710408-A Chiral cis-imidazolines HOFFMANN LA ROCHE 2015-06-17 CN claimed
CN-101821251-A Chiral cis-imidazolines HOFFMANN LA ROCHE 2010-09-01 CN claimed
CN-119894895-A IRAK4 degradation agent and application thereof 领泰生物医药(绍兴)有限公司 2025-04-25 CN disclosed
CN-119233974-A Indolone derivative and application thereof 康百达(四川)生物医药科技有限公司 2024-12-31 CN disclosed
CN-113412259-B Difunctional compounds for degrading BTK via the ubiquitin proteasome pathway 紐力克斯治疗公司 2024-07-16 CN disclosed
CN-114080384-B Herbicidal cyclohexanedione derivatives 先正达农作物保护股份公司 2024-07-12 CN disclosed
CN-116323562-B Compounds with kinase inhibitory activity 上海赛岚生物科技有限公司 2024-06-21 CN disclosed
CN-118206550-A SHP2 inhibitor and application thereof 江苏威凯尔医药科技有限公司 2024-06-18 CN disclosed
CN-118103074-A Cytotoxic targeting chimeras for CCR2 expressing cells 葛兰素史克知识产权发展有限公司 2024-05-28 CN disclosed
CN-114728938-B Tetrahydroisoquinoline spiro compounds as PRMT5 inhibitors 南京再明医药有限公司 2024-05-24 CN disclosed
CN-101687822-A Di(arylamino)aryl compound ASTELLAS PHARMA INC 2010-03-31 CN disclosed
CN-101305005-A Novel diazaspiroalkanes and their use for treatment of CCR8 mediated diseases ASTRAZENECA AB (SE) 2008-11-12 CN disclosed
CN-101163696-A Histone deacetylase inhibitors CHROMA THERAPEUTICS LTD (GB) 2008-04-16 CN disclosed
CN-101155811-A Novel diazaspiroalkanes and their use for treatment of ccr8 mediated diseases ASTRAZENECA AB (SE) 2008-04-02 CN disclosed
CN-101155812-A Novel diazaspiroalkanes and their use to treat CCR8 mediated diseases ASTRAZENECA AB (SE) 2008-04-02 CN disclosed
CN-101155810-A Novel diazaspiroalkanes and their use for treatment of ccr8 mediated diseases ASTRAZENECA AB (SE) 2008-04-02 CN disclosed
CN-1898239-A Novel diazaspiroalkanes and their use in the treatment of CCR8 mediated diseases ASTRAZENECA AB (SE) 2007-01-17 CN disclosed
WO-2003053941-A2 BARBITURIC ACID DERIVATIVES AS INHIBITORS OF TNF-ALPHA CONVERTING ENZYME (TACE) AND/OR MATRIX METALLOPROTEINASES BRISTOL-MYERS SQUIBB COMPANY (US) 2003-07-03 WO disclosed