SCHEMBL23950411

SCHEMBL23950411

CC(C)c1nn2c(N(C)C)nn(CC(=O)O)c(=O)c2c1Br

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CSNK2A2 P19784 2/20 0.40
CSNK2A1 P68400 2/20 0.40
ALOX15 P16050 1/20 0.31
ALDH1A1 P00352 1/20 0.31
HTT P42858 1/20 0.30
LMNA P02545 1/20 0.30
NLRP3 Q96P20 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
SCHEMBL23950975 0.86 GAA (0.37) ALDH1A1HTT
SCHEMBL23950412 0.79 NLRP3 (0.49) ALDH1A1HTTLMNANLRP3
SCHEMBL23950407 0.72 LMNA (0.37) ALOX15ALDH1A1LMNANLRP3
SCHEMBL23950475 0.72 KDM4E (0.40) ALDH1A1HTT
SCHEMBL23952028 0.68 NLRP3 (0.43) ALOX15LMNANLRP3
SCHEMBL23950175 0.64 ALOX15 (0.40) ALOX15LMNANLRP3
SCHEMBL24077124 0.62 NLRP3 (0.47) ALOX15ALDH1A1HTTLMNANLRP3
SCHEMBL23950176 0.62 NLRP3 (0.42) ALOX15LMNANLRP3
SCHEMBL24076314 0.62 NLRP3 (0.65) ALOX15HTTNLRP3
SCHEMBL26730529 0.61 LMNA (0.42) ALDH1A1HTTLMNANLRP3

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 3 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
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 CSNK2A2 4221/4885CSNK2A1 4008/4885ALOX15 331/4885

“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.