SCHEMBL22012739

SCHEMBL22012739

CC(C)(O)c1sc(S(=O)(=O)N[Si](C)(C)C(C)(C)C)cc1-c1ccccc1

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PLK1 P53350 1/20 0.36
LOXL2 Q9Y4K0 6/20 0.32
EDNRB P24530 4/20 0.32
EDNRA P25101 4/20 0.32
MAOA P21397 1/20 0.32
LOX P28300 1/20 0.32
CASP1 P29466 1/20 0.32
FBP1 P09467 1/20 0.31
MAPT P10636 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
ACLY P53396 2/20 0.31
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31
GAA P10253 1/20 0.31

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
SCHEMBL22014857 0.81 HPGD (0.33) EDNRBEDNRAMAPTNPSR1
SCHEMBL22020697 0.78
SCHEMBL22012738 0.78 CA2 (0.41) PLK1LOXL2MAOALOX
SCHEMBL21962325 0.77 LOXL2 (0.34) PLK1LOXL2MAOALOXMAPT
SCHEMBL25033769 0.74 EDNRB (0.51) EDNRBEDNRAMAPT
SCHEMBL20681132 0.74 GAA (0.31) GAA
SCHEMBL22014873 0.71 L3MBTL1 (0.33) MAPTGAA
SCHEMBL10680402 0.70 KEAP1 (0.48) EDNRBEDNRANPSR1ALDH1A1LMNA
SCHEMBL20698974 0.70
SCHEMBL25067022 0.67 NLRP3 (0.46) MAPTNPSR1ALDH1A1LMNAGAA

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 PLK1 2127/4885LOXL2 1004/4885EDNRB 705/4885

“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.