SCHEMBL23950626

SCHEMBL23950626

COc1ccncc1NC(=O)Cn1nc(C(C)C)n2nc(C3CC3)cc2c1=O

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
NLRP3 Q96P20 7/20 0.52
MAPT P10636 2/20 0.41
POLB P06746 1/20 0.41
TP53 P04637 3/20 0.39
THRB P10828 1/20 0.39
PDE4B Q07343 1/20 0.39
GSK3A P49840 1/20 0.38
GSK3B P49841 1/20 0.38
KMT2A Q03164 1/20 0.37
TDP1 Q9NUW8 1/20 0.37

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
SCHEMBL23950596 0.89 NLRP3 (0.54) NLRP3MAPTPOLBTP53
SCHEMBL23950533 0.88 NLRP3 (0.53) NLRP3MAPTPOLBPDE4B
SCHEMBL23950540 0.87 NLRP3 (0.54) NLRP3MAPT
SCHEMBL23950544 0.86 NLRP3 (0.53) NLRP3MAPTPOLBTP53PDE4B
SCHEMBL23950814 0.86 NLRP3 (0.53) NLRP3MAPTPOLBTP53
SCHEMBL23950465 0.84 NLRP3 (0.58) NLRP3KMT2A
SCHEMBL23950515 0.83 NLRP3 (0.52) NLRP3MAPTPOLBTP53KMT2A
SCHEMBL23950468 0.83 NLRP3 (0.60) NLRP3MAPT
SCHEMBL23951001 0.83 NLRP3 (0.51) NLRP3MAPTPOLBTP53KMT2A
SCHEMBL23950566 0.82 NLRP3 (0.63) NLRP3

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 1/4885MAPT 1369/4885POLB 4527/4885

“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.