SCHEMBL21962522

SCHEMBL21962522

CC(C)(C)[Si](C)(C)NS(=N)(=O)c1ccc(-c2ccccc2O)s1

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HSD17B2 P37059 4/20 0.38
HSD17B1 P14061 3/20 0.38
BRAF P15056 1/20 0.32
PFKFB3 Q16875 3/20 0.32
CA1 P00915 3/20 0.32
CA2 P00918 3/20 0.32
CA12 O43570 2/20 0.32
CA9 Q16790 2/20 0.32
CA4 P22748 1/20 0.31
CA7 P43166 1/20 0.31
GHSR Q92847 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
HTR2B P41595 1/20 0.30
HPGD P15428 1/20 0.30
PFKFB4 Q16877 1/20 0.30
ESRRG P62508 1/20 0.30
PTGES2 Q9H7Z7 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
SCHEMBL22013641 0.86 MAPT (0.33) CA1CA2CA12CA9
SCHEMBL22012121 0.74 CA1 (0.34) HSD17B2HSD17B1CA1CA2CA12
SCHEMBL5646084 0.71 CA2 (0.55) HSD17B2HSD17B1CA1CA2CA12
SCHEMBL25144782 0.69 NLRP3 (0.36)
SCHEMBL21962454 0.69 CYP2D6 (0.33) MEN1KMT2A
SCHEMBL25033769 0.69 EDNRB (0.51) PFKFB3GHSRPFKFB4
SCHEMBL23569179 0.65 NLRP3 (0.33)
SCHEMBL21810681 0.65
SCHEMBL20680982 0.64 CCR4 (0.38) PTGES2
SCHEMBL23569877 0.64 PTGS2 (0.42) MEN1KMT2ANPSR1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3880659-B1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY NOVARTIS AG (CH) 2024-01-03 EP disclosed
US-20230051589-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY NOVARTIS AG (CH) 2023-02-16 US disclosed
EP-3880659-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY Novartis AG (CH) 2021-09-22 EP 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 HSD17B2 650/4885HSD17B1 651/4885BRAF 2260/4885

“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.