SCHEMBL30061337

SCHEMBL30061337

CC(C)c1nn(CC(=O)Nc2ccncn2)c(=O)c2cc(Br)cn12

nearest known ligand 0.79

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
NLRP3 Q96P20 11/20 0.79
MAPT P10636 2/20 0.39
DHODH Q02127 1/20 0.39
TSHR P16473 1/20 0.38
HTT P42858 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
FPR1 P21462 1/20 0.37
FPR2 P25090 1/20 0.37
NTRK1 P04629 2/20 0.37
RXFP1 Q9HBX9 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
SCHEMBL23952369 1.00 NLRP3 (0.79) NLRP3MAPTDHODHTSHRHTT
SCHEMBL23952442 0.89 NLRP3 (0.80) NLRP3MAPTDHODHTSHRHTT
SCHEMBL25818822 0.89 NLRP3 (0.80) NLRP3MAPTDHODHTSHRHTT
SCHEMBL23952059 0.88 NLRP3 (1.00) NLRP3MAPTDHODHTSHRHTT
SCHEMBL30059643 0.88 NLRP3 (1.00) NLRP3MAPTDHODHTSHRHTT
SCHEMBL23952054 0.88 NLRP3 (0.79) NLRP3MAPTDHODHTSHRHTT
SCHEMBL23952057 0.88 NLRP3 (0.79) NLRP3MAPTDHODHTSHRHTT
SCHEMBL23952202 0.87 NLRP3 (0.78) NLRP3MAPTDHODHTSHRHTT
SCHEMBL23952390 0.87 NLRP3 (0.81) NLRP3MAPTDHODHTSHRHTT
SCHEMBL23952424 0.87 NLRP3 (0.78) NLRP3MAPTDHODHTSHRHTT

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
EP-4135842-B1 PYRROLO[1,2-D][1,2,4]TRIAZINE-2-YL-ACETAMIDES AS INHIBITORS OF THE NLRP3 INFLAMMASOME PATHWAY JANSSEN PHARMACEUTICA NV (BE) 2024-10-23 EP disclosed
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
EP-4135842-A1 PYRROLO[1,2-D][1,2,4]TRIAZINE-2-YL-ACETAMIDES AS INHIBITORS OF THE NLRP3 INFLAMMASOME PATHWAY JANSSEN Pharmaceutica NV (BE) 2023-02-22 EP disclosed
CN-115485026-A Pyrazolo [1,2-D ] [1,2,4] triazin-2-yl-acetamides as NLRP3 inflammatory pathway inhibitors 詹森药业有限公司 2022-12-16 CN disclosed
WO-2022122037-A1 DIHYDROISOQUINOLINONE DERIVATIVE AND APPLICATION THEREOF 上海奕拓医药科技有限责任公司 2022-06-16 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-20230183248-A1 PYRROLO[1,2-D][1,2,4]TRIAZINE-2-YL-ACETAMIDES AS INHIBITORS OF THE NLRP3 INFLAMMASOME PATHWAY NLRP3, NLRP1, IL1B NLRP3 1/4885MAPT 1978/4885DHODH 1822/4885

“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.