SCHEMBL6695690

SCHEMBL6695690

CCCCC(OC)C(=O)CC

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CA2 P00918 8/20 0.44
CA1 P00915 4/20 0.44
MAPK1 P28482 1/20 0.39
ZDHHC7 Q9NXF8 1/20 0.37
FDPS P14324 1/20 0.35
TSHR P16473 2/20 0.35
CYP3A4 P08684 1/20 0.35
ATM Q13315 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
GPR84 Q9NQS5 2/20 0.33
NAAA Q02083 1/20 0.33
SLC1A3 P43003 1/20 0.33
SLC1A2 P43004 1/20 0.33
SLC1A1 P43005 1/20 0.33

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
SCHEMBL27953181 0.84 CA2 (0.43) CA2CA1MAPK1ZDHHC7TSHR
SCHEMBL28846728 0.81 CA2 (0.38) CA2CA1MAPK1ZDHHC7FDPS
SCHEMBL5165914 0.80 CA2 (0.45) CA2CA1MAPK1ZDHHC7FDPS
SCHEMBL26940441 0.80 CA2 (0.50) CA2CA1MAPK1ZDHHC7TDP1
SCHEMBL1784628 0.80 CA2 (0.45) CA2CA1MAPK1ZDHHC7FDPS
SCHEMBL192696 0.80 CA2 (0.50) CA2CA1MAPK1ZDHHC7TDP1
SCHEMBL11428429 0.79 FDPS (0.47) CA2CA1FDPS
SCHEMBL5200841 0.78 CA2 (0.59) CA2CA1MAPK1ZDHHC7TSHR
SCHEMBL25582929 0.78 CA2 (0.52) CA2CA1MAPK1ZDHHC7FDPS
SCHEMBL16908584 0.78 CA2 (0.52) CA2CA1MAPK1ZDHHC7FDPS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107787337-A Aldimines and ketimines as initiators in curing agent systems and corresponding resin compositions, in particular for fixing technology 费希尔厂有限责任两合公司 2018-03-09 CN claimed
CN-102648230-B The extremely low low viscosity epoxy resin compositions of blushing SIKA技术股份公司 2017-03-01 CN claimed
CN-110402277-A Water swellable moisture cured mono-component polyurethane sealant SIKA TECH AG 2019-11-01 CN disclosed
CN-106986867-B Heterocycle amine as PI3K inhibitor 因塞特控股公司 2019-06-28 CN disclosed
CN-208917109-U Minodronate intermediate synthesis system 南京拉艾夫医药科技有限公司 2019-05-31 CN disclosed
CN-109678859-A Dihydropyrimidines and its application in drug 广东东阳光药业有限公司 2019-04-26 CN disclosed
CN-109600993-A Anti-EGFR antibody drug conjugates 艾伯维公司 2019-04-09 CN disclosed
CN-109563167-A ANTI-B7-H3 ANTIBODIES AND ANTIBODY DRUG CONJUGATES 艾伯维公司 2019-04-02 CN disclosed
CN-109563232-A With the mechanical performance not being affected by temperature substantially and high-intensitive two component polyurethane adhesive SIKA技术股份公司 2019-04-02 CN disclosed
CN-109562169-A anti-CD 98 antibodies and antibody drug conjugates 艾伯维公司 2019-04-02 CN disclosed
CN-106132928-B Anil, the medical composition and its use containing the derivative 橘生药品工业株式会社 2019-03-29 CN disclosed
CN-107206343-A Assign the microcapsules of strong vanilla odor aromatic 弗门尼舍有限公司 2017-09-26 CN disclosed
CN-104619702-B Fused cyclopentyl antagonists of CCR2 詹森药业有限公司 2017-09-15 CN disclosed
CN-107108836-A Two-component composition SIKA技术股份公司 2017-08-29 CN disclosed
CN-106986867-A It is used as the heterocyclic radical amine of PI3K inhibitor 因塞特控股公司 2017-07-28 CN disclosed
CN-102816540-B Binding system comprising adhesive or sealant and tackifier SIKA技术股份公司 2017-07-18 CN disclosed
CN-104812766-B For the method for synthesizing amino alkylene phosphonic acids 斯特雷特马克控股股份公司 2017-06-06 CN disclosed
CN-102648230-B The extremely low low viscosity epoxy resin compositions of blushing SIKA技术股份公司 2017-03-01 CN disclosed
CN-106132928-A Novel anil, medical composition and its use containing described derivant 橘生药品工业株式会社 2016-11-16 CN disclosed
US-20040181094-A1 Transition metal oxo complexes as catalysts of synthetic processes involving alkyne reactants REGENTS OF THE UNIVERSITY OF CALIFORNIA, THE 2004-09-16 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20040181094-A1 Transition metal oxo complexes as catalysts of synthetic processes involving alkyne reactants POLR1G, PYM1, APEX1 CA2 1806/4885CA1 1493/4885MAPK1 4675/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.