SCHEMBL13489636

SCHEMBL13489636

CNC(=O)C(OC(N)=O)c1csc2ccc(Cl)cc12

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CMA1 P23946 15/20 0.47
PRSS1 P07477 1/20 0.46
PRSS2 P07478 1/20 0.46
CTSG P08311 1/20 0.46
PRSS3 P35030 1/20 0.46
CYP2A6 P11509 1/20 0.40
KEAP1 Q14145 1/20 0.40
NFE2L2 Q16236 1/20 0.40
MAPT P10636 1/20 0.38

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
SCHEMBL13931830 0.83 CMA1 (0.43) CMA1PRSS1PRSS2CTSGPRSS3
SCHEMBL8289102 0.83 CMA1 (0.70) CMA1PRSS1PRSS2CTSGPRSS3
SCHEMBL10197824 0.82 CMA1 (0.43) CMA1PRSS1PRSS2CTSGPRSS3
SCHEMBL10197820 0.80 CMA1 (0.52) CMA1PRSS1PRSS2CTSGPRSS3
SCHEMBL13490146 0.73 CMA1 (0.39) CMA1PRSS1PRSS2CTSGPRSS3
SCHEMBL12314971 0.71 CMA1 (0.56) CMA1PRSS1PRSS2CTSGPRSS3
SCHEMBL12314964 0.71 CMA1 (0.50) CMA1PRSS1PRSS2CTSGPRSS3
SCHEMBL12314988 0.70 CMA1 (0.50) CMA1PRSS1PRSS2CTSGPRSS3
SCHEMBL20769662 0.70 KEAP1 (0.52) CMA1PRSS1PRSS2CTSGPRSS3
SCHEMBL7476503 0.68 CYP2A6 (0.59) CMA1PRSS1PRSS2CTSGPRSS3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100048513-A1 Novel inhibitors of chymase HAWKINS MICHAEL J 2010-02-25 US disclosed
US-7459444-B2 Inhibitors of chymase JANSSEN PHARMACEUTICA N.V. (BE) 2008-12-02 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-20100048513-A1 Novel inhibitors of chymase CMA1, SERPINB1, TPSAB1 CMA1 1/4885PRSS1 5/4885PRSS2 20/4885

“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.