SCHEMBL25633974

SCHEMBL25633974

CC(C)c1nn(CC(=O)Nc2ccncn2)c(=O)c2cc3ccccc3n12

nearest known ligand 0.65

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NLRP3 Q96P20 8/20 0.65
THRB P10828 1/20 0.48
TP53 P04637 2/20 0.44
MAPT P10636 1/20 0.43
RXFP1 Q9HBX9 1/20 0.42
TSHR P16473 2/20 0.41
KDM4E B2RXH2 1/20 0.41
GAA P10253 1/20 0.41
MAPK1 P28482 1/20 0.41
HSD17B10 Q99714 1/20 0.41
HTT P42858 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
NPC1 O15118 2/20 0.41
MEN1 O00255 1/20 0.40
RAB9A P51151 1/20 0.40
KMT2A Q03164 1/20 0.40

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
SCHEMBL30073546 0.94 NLRP3 (0.59) NLRP3THRBTP53MAPTRXFP1
SCHEMBL25633360 0.91 NLRP3 (0.55) NLRP3THRBTP53MAPTRXFP1
SCHEMBL25220683 0.86 NLRP3 (0.54) NLRP3THRBTP53MAPTRXFP1
SCHEMBL25634319 0.86 NLRP3 (0.71) NLRP3THRBTP53MAPTNPC1
SCHEMBL30073579 0.86 NLRP3 (0.54) NLRP3THRBTP53MAPTRXFP1
SCHEMBL30073597 0.85 NLRP3 (0.53) NLRP3THRBTP53MAPTRXFP1
SCHEMBL25633881 0.85 NLRP3 (0.53) NLRP3THRBTP53MAPTRXFP1
SCHEMBL25634001 0.85 NLRP3 (0.53) NLRP3THRBTP53MAPTRXFP1
SCHEMBL30528660 0.84 NLRP3 (0.62) NLRP3THRBTP53MAPTRXFP1
SCHEMBL25633362 0.84 NLRP3 (0.51) NLRP3THRBTP53MAPTRXFP1

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-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 NLRP3 1/4885THRB 277/4885TP53 1754/4885

“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.