SCHEMBL23950445

SCHEMBL23950445

CCc1cc2c(=O)n(CC(=O)Nc3ccncn3)nc(CC)n2n1

nearest known ligand 0.64

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
NLRP3 Q96P20 8/20 0.64
POLB P06746 2/20 0.41
THRB P10828 2/20 0.41
MAPT P10636 1/20 0.41
RXFP1 Q9HBX9 1/20 0.40
TP53 P04637 3/20 0.39
TSHR P16473 1/20 0.39
HTT P42858 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39

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
SCHEMBL23950621 0.93 NLRP3 (0.63) NLRP3POLBTHRBMAPTRXFP1
SCHEMBL28965275 0.91 NLRP3 (0.59) NLRP3POLBTHRBMAPTRXFP1
SCHEMBL23950619 0.90 NLRP3 (0.64) NLRP3POLBTHRBMAPTRXFP1
SCHEMBL23925465 0.90 NLRP3 (0.64) NLRP3POLBTHRBMAPTRXFP1
SCHEMBL23950207 0.89 NLRP3 (0.62) NLRP3POLBTHRBMAPTRXFP1
SCHEMBL23950398 0.88 NLRP3 (0.62) NLRP3POLBTHRBMAPTRXFP1
SCHEMBL30041730 0.88 NLRP3 (0.61) NLRP3POLBTHRBMAPTRXFP1
SCHEMBL25242484 0.88 NLRP3 (0.61) NLRP3POLBTHRBMAPTRXFP1
SCHEMBL23950208 0.87 NLRP3 (0.69) NLRP3MAPTTP53TSHRHTT
SCHEMBL30040424 0.87 NLRP3 (0.69) NLRP3MAPTTP53TSHRHTT

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 3 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
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 1/4885POLB 4527/4885THRB 2320/4885

“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.