SCHEMBL23950802

SCHEMBL23950802

Cc1nccc(NC(=O)Cn2nc(C(C)C)n3nc(C4CC4)cc3c2=O)c1F

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
NLRP3 Q96P20 13/20 0.53
TP53 P04637 1/20 0.37
MAPT P10636 1/20 0.37
RXFP1 Q9HBX9 1/20 0.37
POLB P06746 1/20 0.37
THRB P10828 1/20 0.37
USP2 O75604 1/20 0.37
ALDH1A1 P00352 1/20 0.37
HPGD P15428 1/20 0.37
GPR139 Q6DWJ6 1/20 0.36
KCNH2 Q12809 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
SCHEMBL23950471 0.90 NLRP3 (0.53) NLRP3TP53MAPTUSP2ALDH1A1
SCHEMBL23951001 0.88 NLRP3 (0.51) NLRP3TP53MAPTRXFP1POLB
SCHEMBL23950521 0.88 NLRP3 (0.54) NLRP3MAPTRXFP1POLBTHRB
SCHEMBL23950620 0.86 NLRP3 (0.55) NLRP3TP53MAPTGPR139KCNH2
SCHEMBL23950814 0.85 NLRP3 (0.53) NLRP3TP53MAPTRXFP1POLB
SCHEMBL23950540 0.84 NLRP3 (0.54) NLRP3MAPTRXFP1USP2ALDH1A1
SCHEMBL23950624 0.83 NLRP3 (0.55) NLRP3RXFP1
SCHEMBL23950596 0.83 NLRP3 (0.54) NLRP3TP53MAPTRXFP1POLB
SCHEMBL23950515 0.82 NLRP3 (0.52) NLRP3TP53MAPTRXFP1POLB
SCHEMBL23950520 0.82 NLRP3 (0.55) NLRP3ALDH1A1

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 1/4885TP53 2445/4885MAPT 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.