SCHEMBL22012877

SCHEMBL22012877

CN(Cc1csc(S(=O)(=O)N[Si](C)(C)C(C)(C)C)c1)C(=O)OC(C)(C)C

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GLS O94925 2/20 0.36
HTR2C P28335 5/20 0.34
SLC6A4 P31645 5/20 0.34
CACNA1G O43497 1/20 0.33
CACNA1B Q00975 1/20 0.33
CACNA1C Q13936 1/20 0.33
ALDH1A1 P00352 1/20 0.31
MMP13 P45452 1/20 0.31
LIMK2 P53671 1/20 0.30
HTR2A P28223 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
SCHEMBL22012876 0.80 CA2 (0.41) GLSHTR2CSLC6A4CACNA1GCACNA1B
SCHEMBL26007609 0.80 LIMK2 (0.40) GLSHTR2CSLC6A4ALDH1A1LIMK2
SCHEMBL22012873 0.79 HTR2C (0.33) GLSHTR2CSLC6A4CACNA1GCACNA1B
SCHEMBL22012872 0.79 HTR2C (0.35) GLSHTR2CSLC6A4CACNA1GCACNA1B
SCHEMBL20692403 0.77 SCN3A (0.38) GLSHTR2CSLC6A4CACNA1GCACNA1B
SCHEMBL22012128 0.77 HTR2C (0.33) GLSHTR2CSLC6A4CACNA1GCACNA1B
SCHEMBL24978444 0.76 CA2 (0.33) ALDH1A1
SCHEMBL25033756 0.75 CACNA1G (0.35) GLSHTR2CSLC6A4CACNA1GCACNA1B
SCHEMBL21962676 0.73 HTR2C (0.37) GLSHTR2CSLC6A4CACNA1GCACNA1B
SCHEMBL27805823 0.72 HTR2C (0.41) GLSHTR2CSLC6A4CACNA1GCACNA1B

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-20230051589-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY NOVARTIS AG (CH) 2023-02-16 US disclosed
WO-2020102576-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY NOVARTIS INFLAMMASOME RESEARCH, INC. (US) 2020-05-22 WO 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-20230051589-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY NLRP1, NLRP3, NOD1 GLS 348/4885HTR2C 3684/4885SLC6A4 2720/4885

“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.