SCHEMBL23950465

SCHEMBL23950465

CC(C)c1nn(CC(=O)Nc2ccncc2)c(=O)c2cc(C3CC3)nn12

nearest known ligand 0.58

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
NLRP3 Q96P20 13/20 0.58
ORAI1 Q96D31 1/20 0.40
KMT2A Q03164 1/20 0.40
FPR1 P21462 1/20 0.40
FPR2 P25090 1/20 0.40
NTRK1 P04629 2/20 0.39
ALDH1A1 P00352 1/20 0.38
HPGD P15428 1/20 0.38
HTT P42858 1/20 0.38
KCNH2 Q12809 1/20 0.38
NTRK2 Q16620 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
SCHEMBL23950803 0.90 NLRP3 (0.55) NLRP3ORAI1KMT2AFPR1FPR2
SCHEMBL23950468 0.89 NLRP3 (0.60) NLRP3ALDH1A1HTT
SCHEMBL23950624 0.89 NLRP3 (0.55) NLRP3KMT2ANTRK1
SCHEMBL23950479 0.89 NLRP3 (0.58) NLRP3NTRK1KCNH2NTRK2
SCHEMBL23950566 0.88 NLRP3 (0.63) NLRP3HTTKCNH2
SCHEMBL23950618 0.87 NLRP3 (0.53) NLRP3ORAI1KMT2ANTRK1
SCHEMBL25753593 0.87 NLRP3 (0.53) NLRP3KMT2ANTRK1
SCHEMBL23950625 0.87 NLRP3 (0.53) NLRP3KMT2AFPR1FPR2NTRK1
SCHEMBL23950540 0.86 NLRP3 (0.54) NLRP3NTRK1ALDH1A1HPGDKCNH2
SCHEMBL23950596 0.86 NLRP3 (0.54) NLRP3NTRK1ALDH1A1HPGDHTT

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 2 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
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 NLRP3 1/4885ORAI1 1489/4885KMT2A 3325/4885

“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.