SCHEMBL25239667

SCHEMBL25239667

CCN1CC[C@@H](O)[C@@H](NC(=O)Cn2nc(C(C)C)n3nc(C4CC4)cc3c2=O)C1

nearest known ligand 0.76

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
NLRP3 Q96P20 11/20 0.76
KCNH2 Q12809 1/20 0.37
POLB P06746 1/20 0.35
HTR4 Q13639 1/20 0.34
GPR139 Q6DWJ6 1/20 0.34
THRB P10828 1/20 0.33
UBE2N P61088 1/20 0.33
KMT2A Q03164 2/20 0.33

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
SCHEMBL25284352 0.86 NLRP3 (1.00) NLRP3KCNH2POLBHTR4GPR139
SCHEMBL23950377 0.84 NLRP3 (0.70) NLRP3KCNH2GPR139
SCHEMBL23925407 0.82 NLRP3 (0.68) NLRP3KCNH2GPR139THRB
SCHEMBL23950383 0.81 NLRP3 (0.66) NLRP3KCNH2THRB
SCHEMBL25242095 0.78 NLRP3 (0.64) NLRP3KCNH2POLBGPR139THRB
SCHEMBL23950172 0.78 NLRP3 (0.60) NLRP3KCNH2POLBGPR139THRB
SCHEMBL23950385 0.77 NLRP3 (0.61) NLRP3KCNH2THRB
SCHEMBL23950816 0.77 NLRP3 (0.61) NLRP3KCNH2THRB
SCHEMBL25752826 0.77 NLRP3 (0.61) NLRP3KCNH2THRB
SCHEMBL23950466 0.76 NLRP3 (0.59) NLRP3KCNH2GPR139

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 2596/4885POLB 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.