SCHEMBL30244237

SCHEMBL30244237

CC(C)(O)c1ccc(S(=N)(N)=O)s1

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.38
PTGS2 P35354 2/20 0.36
PTGS1 P23219 1/20 0.36
LMNA P02545 2/20 0.34
TSHR P16473 1/20 0.34
YEATS4 O95619 1/20 0.32
CA2 P00918 6/20 0.32
PPARG P37231 1/20 0.32
NCOA2 Q15596 1/20 0.32
NCOA1 Q15788 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
NCOA3 Q9Y6Q9 1/20 0.32
MAPK1 P28482 1/20 0.30
KMT2A Q03164 1/20 0.30
CA12 O43570 1/20 0.30
CA1 P00915 1/20 0.30
CA9 Q16790 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
SCHEMBL7144005 0.85 CA2 (0.44) L3MBTL1PTGS2PTGS1CA2CA12
SCHEMBL20692373 0.74 L3MBTL1 (0.33) L3MBTL1PTGS2PTGS1
SCHEMBL7851232 0.69 L3MBTL1 (0.43) L3MBTL1CA2MAPK1KMT2ACA12
SCHEMBL22014873 0.69 L3MBTL1 (0.33) L3MBTL1KMT2A
SCHEMBL22020051 0.69 PTGS2 (0.37) PTGS2PTGS1
SCHEMBL20680910 0.69 LOXL2 (0.32)
SCHEMBL21962132 0.69 CA2 (0.47) L3MBTL1PTGS2PTGS1CA2CA12
SCHEMBL21962541 0.69 CA2 (0.47) L3MBTL1PTGS2PTGS1CA2CA12
SCHEMBL20681173 0.69 MLYCD (0.37) PTGS2PTGS1CA2CA12CA1
SCHEMBL21962134 0.69 CA2 (0.47) L3MBTL1PTGS2PTGS1CA2CA12

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
EP-3658539-B1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY NOVARTIS AG (CH) 2024-02-21 EP disclosed
US-20230051589-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY NOVARTIS AG (CH) 2023-02-16 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-20230051589-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY NLRP1, NLRP3, NOD1 L3MBTL1 4806/4885PTGS2 1219/4885PTGS1 1116/4885

“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.