SCHEMBL23950533

SCHEMBL23950533

CC(C)c1nn(CC(=O)Nc2cnccc2Cl)c(=O)c2cc(C3CC3)nn12

nearest known ligand 0.53

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
NLRP3 Q96P20 14/20 0.53
GPR139 Q6DWJ6 1/20 0.40
PDE4B Q07343 1/20 0.40
KCNH2 Q12809 1/20 0.38
MAPT P10636 1/20 0.38
BCL6 P41182 1/20 0.37
POLB P06746 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
SCHEMBL23950544 0.93 NLRP3 (0.53) NLRP3GPR139PDE4BKCNH2MAPT
SCHEMBL23950596 0.90 NLRP3 (0.54) NLRP3KCNH2MAPTPOLB
SCHEMBL23950540 0.89 NLRP3 (0.54) NLRP3KCNH2MAPT
SCHEMBL23950626 0.88 NLRP3 (0.52) NLRP3PDE4BMAPTPOLB
SCHEMBL23950814 0.88 NLRP3 (0.53) NLRP3GPR139MAPTPOLB
SCHEMBL23950465 0.86 NLRP3 (0.58) NLRP3KCNH2
SCHEMBL23950520 0.84 NLRP3 (0.55) NLRP3
SCHEMBL23950468 0.84 NLRP3 (0.60) NLRP3MAPT
SCHEMBL23950620 0.84 NLRP3 (0.55) NLRP3GPR139KCNH2MAPT
SCHEMBL23950566 0.83 NLRP3 (0.63) NLRP3KCNH2

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 1/4885GPR139 1221/4885PDE4B 548/4885

“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.