SCHEMBL23950439

SCHEMBL23950439

CC(C)c1nn(CC(=O)NC2CCCN(CC(F)(F)F)C2)c(=O)c2cc(C3CC3)nn12

nearest known ligand 0.59

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
NLRP3 Q96P20 12/20 0.59
KCNH2 Q12809 1/20 0.42
KMT2A Q03164 1/20 0.41
SLC18A2 Q05940 1/20 0.40
JAK2 O60674 1/20 0.39
JAK1 P23458 1/20 0.39
JAK3 P52333 1/20 0.39
TSHR P16473 2/20 0.36
THRB P10828 2/20 0.36

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
SCHEMBL23950437 1.00 NLRP3 (0.59) NLRP3KCNH2KMT2ASLC18A2JAK2
SCHEMBL23925343 0.85 NLRP3 (0.62) NLRP3KCNH2KMT2ASLC18A2THRB
SCHEMBL23925344 0.85 NLRP3 (0.62) NLRP3KCNH2KMT2ASLC18A2THRB
SCHEMBL25752787 0.84 NLRP3 (0.76) NLRP3KCNH2KMT2ASLC18A2THRB
SCHEMBL25752789 0.84 NLRP3 (0.76) NLRP3KCNH2KMT2ASLC18A2THRB
SCHEMBL23950421 0.82 NLRP3 (0.58) NLRP3KCNH2SLC18A2
SCHEMBL23950811 0.80 NLRP3 (0.61) NLRP3KCNH2SLC18A2THRB
SCHEMBL25752826 0.80 NLRP3 (0.61) NLRP3KCNH2SLC18A2THRB
SCHEMBL23950816 0.80 NLRP3 (0.61) NLRP3KCNH2SLC18A2THRB
SCHEMBL23950428 0.79 NLRP3 (0.63) NLRP3KCNH2SLC18A2THRB

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 1/4885KCNH2 2596/4885KMT2A 3325/4885

“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.