SCHEMBL25033747

SCHEMBL25033747

CN1CCc2sc(S(=O)(=O)N[Si](C)(C)C(C)(C)C)c(F)c2C1

nearest known ligand 0.32

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 1/20 0.32
CHRM3 P20309 1/20 0.32
DRD2 P14416 1/20 0.30
HTR2A P28223 1/20 0.30
HTR2C P28335 1/20 0.30
DRD3 P35462 1/20 0.30
HTR6 P50406 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
SCHEMBL21962483 0.82 KDM4E (0.33) ADORA2A
SCHEMBL25034054 0.80 ADORA1 (0.41)
SCHEMBL22013613 0.79
SCHEMBL25033746 0.79 KMT2A (0.37) ADORA2AHTR6
SCHEMBL21962780 0.76 KDM4E (0.32) ADORA2A
SCHEMBL22012058 0.71 DRD2 (0.36) DRD2HTR2AHTR2CDRD3HTR6
SCHEMBL25034052 0.70 ADORA1 (0.40)
SCHEMBL20692242 0.65 DRD2 (0.47) DRD2HTR2AHTR2CDRD3HTR6
SCHEMBL21962667 0.64 WDR91 (0.35) DRD2HTR2AHTR2CDRD3HTR6
SCHEMBL20692074 0.64 DRD2 (0.46) DRD2HTR2AHTR2CDRD3HTR6

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 1 patent. 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

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 ADORA2A 587/4885CHRM3 4211/4885DRD2 4864/4885

“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.