SCHEMBL23950821

SCHEMBL23950821

CCCCc1nn(CC(=O)Nc2ccc3nncn3c2)c(=O)c2cc(C3CC3)nn12

nearest known ligand 0.54

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
NLRP3 Q96P20 15/20 0.54
ORAI1 Q96D31 2/20 0.40
MAPT P10636 2/20 0.36
KMT2A Q03164 1/20 0.35

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
SCHEMBL23951012 0.88 NLRP3 (0.57) NLRP3ORAI1KMT2A
SCHEMBL23950826 0.85 NLRP3 (0.55) NLRP3ORAI1MAPTKMT2A
SCHEMBL23950609 0.85 NLRP3 (0.72) NLRP3ORAI1
SCHEMBL23950827 0.81 NLRP3 (0.52) NLRP3ORAI1KMT2A
SCHEMBL23950510 0.80 NLRP3 (0.62) NLRP3MAPT
SCHEMBL23950828 0.79 NLRP3 (0.49) NLRP3ORAI1KMT2A
SCHEMBL23950795 0.78 NLRP3 (0.41) NLRP3MAPTKMT2A
SCHEMBL23950813 0.74 NLRP3 (0.58) NLRP3
SCHEMBL23950649 0.74 NLRP3 (0.46) NLRP3KMT2A
SCHEMBL23950798 0.74 NLRP3 (0.38) NLRP3KMT2A

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-20230203044-A1 PYRAZOLO[1,5-D][1,2,4]TRIAZINE-5(4H)-ACETAMIDES AS INHIBITORS OF THE NLRP3 INFLAMMASOME JANSSEN PHARMACEUTICA NV (BE) 2023-06-29 US disclosed
WO-2021209552-A1 PYRAZOLO[1,5-D][1,2,4]TRIAZINE-5(4H)-ACETAMIDES AS INHIBITORS OF THE NLRP3 INFLAMMASOME PATHWAY JANSSEN PHARMACEUTICA NV (BE) 2021-10-21 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-20230203044-A1 PYRAZOLO[1,5-D][1,2,4]TRIAZINE-5(4H)-ACETAMIDES AS INHIBITORS OF THE NLRP3 INFLAMMASOME NLRP3, PYCARD, NLRP1 NLRP3 1/4885ORAI1 1489/4885MAPT 1369/4885

“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.