SCHEMBL21962887

SCHEMBL21962887

COC(=O)c1ccc(S(N)(=O)=N[Si](C)(C)C(C)(C)C)c(C(=O)OC)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.43
ALDH1A1 P00352 4/20 0.43
HPGD P15428 4/20 0.43
HSD17B10 Q99714 3/20 0.43
MAPT P10636 3/20 0.43
GAA P10253 2/20 0.43
GLA P06280 1/20 0.43
CASP1 P29466 1/20 0.43
CASP7 P55210 1/20 0.43
ATM Q13315 1/20 0.43
SMN1; SMN2 Q16637 2/20 0.42
PKM P14618 1/20 0.41
CA2 P00918 7/20 0.40
CA1 P00915 5/20 0.40
CA9 Q16790 5/20 0.40
CA12 O43570 4/20 0.40
CA14 Q9ULX7 3/20 0.40
CA7 P43166 1/20 0.40
XDH P47989 1/20 0.40
VCAM1 P19320 1/20 0.40

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
SCHEMBL21962932 0.90 KDM4E (0.47) KDM4EALDH1A1HPGDHSD17B10MAPT
SCHEMBL21962921 0.79 ABL1 (0.48) KDM4EALDH1A1HPGDHSD17B10MAPT
SCHEMBL21962927 0.79 CA1 (0.42) ALDH1A1HSD17B10MAPTGAASMN1; SMN2
SCHEMBL21962910 0.78 CA2 (0.63) KDM4EALDH1A1HPGDHSD17B10MAPT
SCHEMBL25014891 0.78 KDM4E (0.45) KDM4EALDH1A1HPGDHSD17B10MAPT
SCHEMBL23569220 0.77 CA2 (0.38) KDM4EALDH1A1GAAGLACA2
SCHEMBL21962907 0.75 KDM4E (0.45) KDM4EALDH1A1HPGDHSD17B10MAPT
SCHEMBL30694081 0.75 GAA (0.48) KDM4EALDH1A1MAPTGAACA2
SCHEMBL21962903 0.75 CA2 (0.38) KDM4EALDH1A1HPGDHSD17B10MAPT
SCHEMBL22827853 0.74 EDNRA (0.48) KDM4EALDH1A1HPGDMAPTLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3880666-B1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY NOVARTIS AG (CH) 2023-06-28 EP disclosed
US-20230024859-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY NOVARTIS AG (CH) 2023-01-26 US disclosed
US-20230024859-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY NOVARTIS AG (CH) 2023-01-26 US disclosed
WO-2020102100-A9 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY NOVARTIS AG (CH) 2022-01-06 WO disclosed
EP-3880666-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY Novartis AG (CH) 2021-09-22 EP disclosed
WO-2020102100-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-20230024859-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY NLRP1, NLRP3, NOD1 KDM4E 4507/4885ALDH1A1 2065/4885HPGD 1797/4885

“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.