SCHEMBL24324657

SCHEMBL24324657

Nc1nc(NCc2cnsc2)c2ccc(-c3ccn[nH]3)cc2n1

nearest known ligand 0.66

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
NLRP3 Q96P20 8/20 0.66
APP P05067 11/20 0.40
JAK2 O60674 1/20 0.38

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
SCHEMBL22249410 0.85 NLRP3 (0.69) NLRP3APPJAK2
SCHEMBL22249567 0.84 NLRP3 (0.68) NLRP3APPJAK2
SCHEMBL22249448 0.84 NLRP3 (0.68) NLRP3APPJAK2
SCHEMBL22249447 0.83 NLRP3 (0.67) NLRP3APP
SCHEMBL22249415 0.81 NLRP3 (0.73) NLRP3APPJAK2
SCHEMBL22249320 0.81 NLRP3 (0.67) NLRP3APPJAK2
SCHEMBL22249411 0.80 NLRP3 (0.66) NLRP3APPJAK2
SCHEMBL22249598 0.80 NLRP3 (0.66) NLRP3APPJAK2
SCHEMBL22249392 0.80 NLRP3 (0.68) NLRP3APPJAK2
SCHEMBL22249419 0.80 NLRP3 (0.68) NLRP3APPJAK2

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-20220089571-A1 NLRP3 MODULATORS INNATE TUMOR IMMUNITY INC (US) 2022-03-24 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-20220089571-A1 NLRP3 MODULATORS NLRP3, NLRP1, PYCARD NLRP3 1/4885APP 402/4885JAK2 3025/4885

“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.