SCHEMBL23950503

SCHEMBL23950503

CC(C)(C)OC(=O)NC1CCC(=O)N(CC2CC2)C1

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 7/20 0.49
CTSK P43235 2/20 0.46
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
DRD3 P35462 1/20 0.41
BTK Q06187 1/20 0.40
JAK2 O60674 2/20 0.40
JAK1 P23458 2/20 0.40
CYP2C9 P11712 1/20 0.40
HSD11B1 P28845 1/20 0.40
KMT2A Q03164 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
GAA P10253 1/20 0.39
SCN9A Q15858 1/20 0.38

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
SCHEMBL31292043 0.84 SCN9A (0.49) DRD2CTSKCA1CA2BTK
SCHEMBL28969100 0.81 L3MBTL1 (0.44) DRD2CTSKCA1CA2BTK
SCHEMBL25022225 0.81 L3MBTL1 (0.44) DRD2CTSKCA1CA2BTK
SCHEMBL25593840 0.80 KMT2A (0.59) DRD2KMT2AL3MBTL1GAASCN9A
SCHEMBL25292411 0.79 KMT2A (0.40) KMT2A
SCHEMBL13434254 0.77 CYP3A4 (0.47) CYP2C9KMT2AL3MBTL1
SCHEMBL30289044 0.76 DRD2 (0.51) DRD2CTSKCA1CA2DRD3
SCHEMBL30288922 0.75 DRD2 (0.50) DRD2CTSKCA1CA2DRD3
SCHEMBL13108631 0.74 CTSK (0.45) DRD2CTSKCA1CA2BTK
SCHEMBL30289033 0.74 DRD2 (0.49) DRD2CTSKCA1CA2DRD3

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 4 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
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
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 DRD2 4161/4885CTSK 3145/4885CA1 2253/4885

“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.