SCHEMBL25819159

SCHEMBL25819159

CC(=O)NC(C)c1nn(CC(=O)N(C)c2ccncn2)c(=O)c2cc(C(C)C)cn12

nearest known ligand 0.47

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
NLRP3 Q96P20 7/20 0.47
TP53 P04637 1/20 0.31
BRD4 O60885 1/20 0.30
BRPF1 P55201 1/20 0.30
GPR139 Q6DWJ6 1/20 0.30
ACACB O00763 1/20 0.30

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
SCHEMBL25819064 0.85 NLRP3 (0.44) NLRP3TP53BRD4BRPF1
SCHEMBL23952048 0.83 NLRP3 (0.67) NLRP3TP53GPR139
SCHEMBL25819130 0.82 NLRP3 (0.43) NLRP3TP53BRD4BRPF1
SCHEMBL25819114 0.81 NLRP3 (0.43) NLRP3TP53
SCHEMBL23952357 0.79 NLRP3 (0.47) NLRP3TP53
SCHEMBL25819084 0.79 NLRP3 (0.40) NLRP3ACACB
SCHEMBL25816523 0.79 NLRP3 (0.51) NLRP3TP53
SCHEMBL25817722 0.78 NLRP3 (0.51) NLRP3TP53
SCHEMBL23925308 0.76 NLRP3 (0.43) NLRP3BRD4
SCHEMBL23952354 0.76 NLRP3 (0.44) NLRP3TP53

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230183248-A1 PYRROLO[1,2-D][1,2,4]TRIAZINE-2-YL-ACETAMIDES AS INHIBITORS OF THE NLRP3 INFLAMMASOME PATHWAY JANSSEN PHARMACEUTICA NV (BE) 2023-06-15 US 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-20230183248-A1 PYRROLO[1,2-D][1,2,4]TRIAZINE-2-YL-ACETAMIDES AS INHIBITORS OF THE NLRP3 INFLAMMASOME PATHWAY NLRP3, NLRP1, IL1B NLRP3 1/4885TP53 2459/4885BRD4 337/4885

“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.