SCHEMBL25753795

SCHEMBL25753795

CC(C)c1nn(CC(=O)Nc2ccc(=N)n(C=N)c2)c(=O)c2cc(C(O)C(F)(F)F)nn12

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NLRP3 Q96P20 9/20 0.48
KMT2A Q03164 2/20 0.35
MAPT P10636 2/20 0.35
FPR1 P21462 1/20 0.34
FPR3 P25089 1/20 0.34
FPR2 P25090 1/20 0.34
USP2 O75604 1/20 0.34
ALDH1A1 P00352 1/20 0.34
HPGD P15428 1/20 0.34
HTT P42858 1/20 0.34
TP53 P04637 1/20 0.33
MEN1 O00255 1/20 0.33
RXFP1 Q9HBX9 1/20 0.33

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
SCHEMBL23950431 0.82 NLRP3 (0.70) NLRP3KMT2A
SCHEMBL23950424 0.78 NLRP3 (0.38) NLRP3
SCHEMBL25748548 0.74 NLRP3 (0.51) NLRP3KMT2AMAPTUSP2TP53
SCHEMBL23950435 0.73 NLRP3 (0.59) NLRP3
SCHEMBL25749266 0.73 NLRP3 (0.55) NLRP3KMT2AMAPTUSP2ALDH1A1
SCHEMBL23950600 0.73 NLRP3 (0.79) NLRP3KMT2AFPR1FPR3FPR2
SCHEMBL25749148 0.73 NLRP3 (0.49) NLRP3KMT2AMAPTUSP2ALDH1A1
SCHEMBL23950978 0.73 KDM4E (0.38) NLRP3KMT2AALDH1A1HPGDHTT
SCHEMBL25748545 0.72 NLRP3 (0.55) NLRP3KMT2AMAPTFPR1FPR2
SCHEMBL25749211 0.72 NLRP3 (0.55) NLRP3KMT2AMAPTUSP2ALDH1A1

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-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

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 1/4885KMT2A 3325/4885MAPT 1369/4885

“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.