SCHEMBL22013641

SCHEMBL22013641

CC(C)(C)[Si](C)(C)NS(=N)(=O)c1ccc(-c2ccccc2CO)s1

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.33
CA12 O43570 2/20 0.33
CA1 P00915 2/20 0.33
CA2 P00918 2/20 0.33
CA9 Q16790 2/20 0.33
HIF1A Q16665 1/20 0.33
EPAS1 Q99814 1/20 0.33
SCN9A Q15858 8/20 0.33
KRAS P01116 1/20 0.32
SOS1 Q07889 1/20 0.32
C1S P09871 1/20 0.32
TP53 P04637 1/20 0.32
NPC1 O15118 1/20 0.31
POLB P06746 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
SCHEMBL21962522 0.86 HSD17B2 (0.38) CA12CA1CA2CA9
SCHEMBL21962454 0.70 CYP2D6 (0.33) POLB
SCHEMBL25094675 0.68 PDCD1 (0.40) HIF1AEPAS1KRASSOS1
SCHEMBL25144782 0.68 NLRP3 (0.36)
SCHEMBL24801870 0.68 PDCD1 (0.46) HIF1AEPAS1KRASSOS1TP53
SCHEMBL25033769 0.67 EDNRB (0.51) MAPT
SCHEMBL22012978 0.66 HDAC3 (0.33) POLB
SCHEMBL23569877 0.65 PTGS2 (0.42)
SCHEMBL25078757 0.65 HIF1A (0.45) MAPTHIF1AEPAS1KRASSOS1
SCHEMBL23569179 0.64 NLRP3 (0.33)

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 3 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
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 MAPT 2094/4885CA12 2844/4885CA1 3732/4885

“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.