SCHEMBL25633405

SCHEMBL25633405

CCc1nn(CC(=O)N[C@H]2C[C@@](C)(O)C2)c(=O)c2cc3ccccc3n12

nearest known ligand 0.80

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
THRB P10828 3/20 0.62
TP53 P04637 5/20 0.59
NPC1 O15118 1/20 0.59
MAPT P10636 1/20 0.57
NLRP3 Q96P20 5/20 0.57
KMT2A Q03164 1/20 0.57
SAE1 Q9UBE0 1/20 0.47
UBA2 Q9UBT2 1/20 0.47

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
SCHEMBL25633990 0.89 THRB (0.77) THRBTP53NPC1MAPTNLRP3
SCHEMBL23975810 0.88 KMT2A (0.59) THRBTP53NPC1MAPTNLRP3
SCHEMBL25272160 0.88 KMT2A (0.59) THRBTP53NPC1MAPTNLRP3
SCHEMBL25633409 0.86 NLRP3 (0.72) THRBTP53NPC1MAPTNLRP3
SCHEMBL25633396 0.86 NLRP3 (0.73) THRBTP53NLRP3
SCHEMBL25634301 0.82 TP53 (0.70) THRBTP53NPC1MAPTNLRP3
SCHEMBL25633342 0.79 NPC1 (0.72) THRBTP53NPC1MAPTNLRP3
SCHEMBL23950509 0.79 NLRP3 (0.53) THRBTP53MAPTNLRP3KMT2A
SCHEMBL23975557 0.77 THRB (1.00) THRBTP53NPC1KMT2A
SCHEMBL30073575 0.77 THRB (1.00) THRBTP53NPC1KMT2A

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-20230183249-A1 NEW TRIAZINOINDOLE COMPOUNDS JANSSEN PHARMACEUTICA NV (BE) 2023-06-15 US disclosed
US-20230183249-A1 NEW TRIAZINOINDOLE COMPOUNDS JANSSEN PHARMACEUTICA NV (BE) 2023-06-15 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-20230183249-A1 NEW TRIAZINOINDOLE COMPOUNDS NLRP3, NLRP1, PYCARD THRB 277/4885TP53 1754/4885NPC1 364/4885

“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.