SCHEMBL25067006

SCHEMBL25067006

Cc1cc(C(C)C)c(CC(=O)N=S(N)(=O)c2ccc(CN(C)C)cc2)c(C(C)C)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NLRP3 Q96P20 2/20 0.44
CA1 P00915 6/20 0.35
CA2 P00918 6/20 0.35
CA9 Q16790 5/20 0.35
GSR P00390 1/20 0.35
POLB P06746 1/20 0.34
MEN1 O00255 1/20 0.33
ALDH1A1 P00352 1/20 0.33
LMNA P02545 1/20 0.33
GAA P10253 1/20 0.33
KMT2A Q03164 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
CA12 O43570 2/20 0.33
CA7 P43166 1/20 0.33
MMP1 P03956 1/20 0.32
MMP9 P14780 1/20 0.32
MMP13 P45452 1/20 0.32
ADAM17 P78536 1/20 0.32
HSP90AA1 P07900 2/20 0.32
CNR2 P34972 1/20 0.32

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
SCHEMBL25067039 0.94 NLRP3 (0.40) NLRP3CA1CA2CA9GSR
SCHEMBL20699066 0.91 NLRP3 (0.45) NLRP3CA1CA2CA9MEN1
SCHEMBL22014416 0.89 NLRP3 (0.42) NLRP3CA1CA2GSRPOLB
SCHEMBL20698687 0.89 NLRP3 (0.42) NLRP3CA1CA2GSRCA12
SCHEMBL20698686 0.89 NLRP3 (0.42) NLRP3CA1CA2GSRCA12
SCHEMBL22014583 0.89 NLRP3 (0.42) NLRP3CA1CA2GSRCA12
SCHEMBL20699065 0.88 NLRP3 (0.47) NLRP3CA1CA2CA9CA7
SCHEMBL20698694 0.88 NLRP3 (0.50) NLRP3CA1CA2CA9HSP90AA1
SCHEMBL20698692 0.88 NLRP3 (0.42) NLRP3CA1CA2CA9GSR
SCHEMBL20698842 0.87 NLRP3 (0.44) NLRP3CA1CA2GSRPOLB

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-20230059136-A1 THE COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY NOVARTIS AG (CH) 2023-02-23 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-20230059136-A1 THE COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY NLRP1, NLRP3, NOD1 NLRP3 2/4885CA1 3832/4885CA2 1522/4885

“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.