SCHEMBL3244669

SCHEMBL3244669

C#CC(C)N(C)C(=O)OC(C)(C)C

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 1/20 0.33
AAK1 Q2M2I8 2/20 0.32
HDAC1 Q13547 1/20 0.31
HDAC2 Q92769 1/20 0.31
HDAC6 Q9UBN7 1/20 0.31
HRH3 Q9Y5N1 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
SCHEMBL38666150 1.00 DPP4 (0.33) DPP4AAK1HDAC1HDAC2HDAC6
SCHEMBL27406050 0.82 DPP4 (0.33) DPP4AAK1HDAC1HDAC2HDAC6
SCHEMBL4813601 0.82 HDAC6 (0.32) HDAC1HDAC2HDAC6
SCHEMBL9178624 0.82 HDAC6 (0.32) HDAC1HDAC2HDAC6
SCHEMBL8644149 0.82 DPP4 (0.33) DPP4AAK1HDAC1HDAC2HDAC6
SCHEMBL4813607 0.82 HDAC6 (0.32) HDAC1HDAC2HDAC6
SCHEMBL13489798 0.81 AAK1 (0.31) DPP4AAK1
SCHEMBL7176203 0.81 DPP4 (0.51) DPP4AAK1HDAC1HDAC2HDAC6
SCHEMBL18714767 0.78 MMP13 (0.31) AAK1
SCHEMBL5345861 0.77 AAK1 (0.35) AAK1HDAC1HDAC2HDAC6

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113423427-A IRAK degrading agents and uses thereof 凯麦拉医疗公司 2021-09-21 CN disclosed
CN-112105385-A IRAK degrading agents and uses thereof 凯麦拉医疗公司 2020-12-18 CN disclosed
EP-2341886-B1 ANTIMICROBIAL N-CHLORINATED COMPOSITIONS NOVABAY PHARMACEUTICALS INC (US) 2015-08-26 EP disclosed
US-8278482-B2 Antimicrobial N-chlorinated compositions NOVABAY PHARMACEUTICALS, INC. (US) 2012-10-02 US disclosed
US-20100158818-A1 ANTIMICROBIAL N-CHLORINATED COMPOSITIONS NOVABAY PHARMACEUTICALS, INC. 2010-06-24 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-20100158818-A1 ANTIMICROBIAL N-CHLORINATED COMPOSITIONS NRDC, NHERF1, MPO DPP4 3451/4885AAK1 3828/4885HDAC1 2309/4885

“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.