SCHEMBL22265876

SCHEMBL22265876

CN1CCC(S(=O)(=O)N[Si](c2ccccc2)(c2ccccc2)C(C)(C)C)C1

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ CHRM3 P20309 2/20 0.35
▸ CHRM4 P08173 1/20 0.35
▸ CHRM5 P08912 1/20 0.35
▸ CHRM1 P11229 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ HTR6 P50406 1/20 0.35
▸ HTR2A P28223 2/20 0.35
▸ HTR2C P28335 2/20 0.35
▸ SLC6A2 P23975 4/20 0.34
▸ SLC6A4 P31645 2/20 0.34
▸ SLC6A3 Q01959 2/20 0.34
▸ UCHL1 P09936 1/20 0.34
▸ USP30 Q70CQ3 1/20 0.34
▸ ALDH1A1 P00352 1/20 0.33
▸ CYP1A2 P05177 1/20 0.33
▸ CXCR2 P25025 1/20 0.33
▸ KAT2B Q92831 1/20 0.33

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
SCHEMBL22265851 0.88 KMT2A (0.36) CHRM3CHRM4CHRM5CHRM1KMT2A
SCHEMBL22280117 0.80 KMT2A (0.36) CHRM3KMT2AHTR6HTR2ASLC6A2
SCHEMBL28622272 0.79 STS (0.47) USP30
SCHEMBL22265958 0.78 KMT2A (0.35) CHRM3CHRM1KMT2AHTR6SLC6A2
SCHEMBL22280124 0.72 HTR6 (0.34) CHRM3CHRM4CHRM5CHRM1KMT2A
SCHEMBL22280125 0.72 HTR6 (0.34) CHRM3CHRM4CHRM5CHRM1KMT2A
SCHEMBL22266027 0.69 KEAP1 (0.41) KMT2AHTR6ALDH1A1
SCHEMBL799175 0.68 HTR2A (0.55) HTR6HTR2AHTR2CALDH1A1CXCR2
SCHEMBL18848793 0.65 JAK2 (0.33) CXCR2
SCHEMBL17052875 0.65 JAK2 (0.33) CXCR2

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
US-20220227707-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY NOVARTIS AG (CH) 2022-07-21 — — US disclosed
EP-3914583-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY Novartis AG (CH) 2021-12-01 — — EP disclosed
CN-113316566-A Compounds and compositions for treating conditions associated with NLRP activity 诺华股份有限公司 2021-08-27 — — CN disclosed
WO-2020154321-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY NOVARTIS INFLAMMASOME RESEARCH, INC. (US) 2020-07-30 — — 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-20220227707-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY NLRP1, NLRP3, NOD1 CHRM3 4010/4885CHRM4 4248/4885CHRM5 4021/4885

“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.

Send feedback