SCHEMBL22012885

SCHEMBL22012885

CC(C)(C)OC(=O)N1CCC1c1ccc(S(N)(=O)=N[Si](C)(C)C(C)(C)C)cc1

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 3/20 0.40
NR1H3 Q13133 3/20 0.40
STS P08842 2/20 0.37
CHRNA7 P36544 1/20 0.37
GPR119 Q8TDV5 7/20 0.37
GRM5 P41594 1/20 0.37
RIPK1 Q13546 1/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
HSD11B1 P28845 1/20 0.36

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
SCHEMBL22012882 1.00 NR1H2 (0.40) NR1H2NR1H3STSCHRNA7GPR119
SCHEMBL21962575 0.83 GPR119 (0.50) NR1H2NR1H3STSCHRNA7GPR119
SCHEMBL22012883 0.79 STS (0.43) NR1H2NR1H3STSGPR119RIPK1
SCHEMBL21962692 0.78 GPR119 (0.49) NR1H2NR1H3CHRNA7GPR119RIPK1
SCHEMBL22012470 0.77 NR1H2 (0.40) NR1H2NR1H3STSGPR119RIPK1
SCHEMBL16409297 0.77 CA2 (0.51) NR1H2NR1H3STSCHRNA7GPR119
SCHEMBL22012905 0.76 ALDH1A1 (0.39) MEN1KMT2A
SCHEMBL22013637 0.76 ALDH1A1 (0.39) MEN1KMT2A
SCHEMBL25033880 0.74 KMT2A (0.46) NR1H2NR1H3STSRIPK1MEN1
SCHEMBL14880733 0.73 NR1H2 (0.54) NR1H2NR1H3RIPK1KMT2A

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 NR1H2 334/4885NR1H3 409/4885STS 3017/4885

“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.