SCHEMBL25284352

SCHEMBL25284352

CC(C)c1nn(CC(=O)N[C@H]2CN(C3CCC3)CC[C@H]2O)c(=O)c2cc(C3CC3)nn12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
NLRP3 Q96P20 12/20 1.00
KCNH2 Q12809 1/20 0.38
MDM4 O15151 1/20 0.34
MDM2 Q00987 1/20 0.34
HTR4 Q13639 2/20 0.33
GPR139 Q6DWJ6 1/20 0.33
POLB P06746 1/20 0.33
THRB P10828 1/20 0.33
CHRNA7 P36544 1/20 0.32

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
SCHEMBL25239667 0.86 NLRP3 (0.76) NLRP3KCNH2HTR4GPR139POLB
SCHEMBL25752789 0.86 NLRP3 (0.76) NLRP3KCNH2MDM4MDM2THRB
SCHEMBL25752787 0.86 NLRP3 (0.76) NLRP3KCNH2MDM4MDM2THRB
SCHEMBL23950377 0.82 NLRP3 (0.70) NLRP3KCNH2GPR139
SCHEMBL23925407 0.81 NLRP3 (0.68) NLRP3KCNH2GPR139THRB
SCHEMBL23950383 0.79 NLRP3 (0.66) NLRP3KCNH2THRB
SCHEMBL25242095 0.79 NLRP3 (0.64) NLRP3KCNH2MDM4MDM2GPR139
SCHEMBL23925343 0.77 NLRP3 (0.62) NLRP3KCNH2POLBTHRB
SCHEMBL23950818 0.77 NLRP3 (0.62) NLRP3MDM4MDM2POLBTHRB
SCHEMBL23950172 0.77 NLRP3 (0.60) NLRP3KCNH2GPR139POLBTHRB

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 5 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
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
EP-4135843-A1 PYRAZOLO[1,5-D][1,2,4]TRIAZINE-5(4H)-ACETAMIDES AS INHIBITORS OF THE NLRP3 INFLAMMASOME PATHWAY JANSSEN Pharmaceutica NV (BE) 2023-02-22 EP disclosed
CN-115427110-A Pyrazolo [1,5-D ] [1,2,4] triazine-5 (4H) acetamide as an NLRP3 inflammatory pathway inhibitor 詹森药业有限公司 2022-12-02 CN 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 1/4885KCNH2 2596/4885MDM4 1571/4885

“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.