SCHEMBL22012133

SCHEMBL22012133

CC(C)N(C)c1ccc(S(N)(=O)=N[Si](C)(C)C(C)(C)C)cc1

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CA2 P00918 6/20 0.36
CA1 P00915 4/20 0.36
CA12 O43570 4/20 0.36
CA9 Q16790 4/20 0.35
MEN1 O00255 1/20 0.35
NPC1 O15118 1/20 0.35
POLB P06746 1/20 0.35
RAB9A P51151 1/20 0.35
KMT2A Q03164 1/20 0.35
CA5A P35218 1/20 0.31
CA7 P43166 1/20 0.31
CA5B Q9Y2D0 1/20 0.31
PTGS2 P35354 2/20 0.31
PTGS1 P23219 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
SCHEMBL20692417 0.82 ALDH1A1 (0.33) CA2CA1CA9CA5ACA7
SCHEMBL20698711 0.80 KAT2B (0.31)
SCHEMBL21906432 0.79 CA2 (0.47) CA2CA1CA12CA9MEN1
SCHEMBL21810621 0.79 ENPP2 (0.39) CA2PTGS2
SCHEMBL20698717 0.78 SMYD3 (0.32) CA2CA1CA12
SCHEMBL21810652 0.77 HRH3 (0.37) CA2CA1CA12CA9CA5A
SCHEMBL21810678 0.77 ALDH1A1 (0.43) CA2CA1CA12CA9MEN1
SCHEMBL21722661 0.77 CA1 (0.42) CA2CA1CA12CA9NPC1
SCHEMBL20681591 0.76 HSD11B1 (0.42) CA2CA1MEN1KMT2A
SCHEMBL23568473 0.75 CA2 (0.35) CA2CA1CA12CA9KMT2A

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 CA2 1210/4885CA1 3732/4885CA12 2844/4885

“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.