SCHEMBL25633964

SCHEMBL25633964

COc1ncccc1NC(=O)Cn1nc(C(C)C)n2c(cc3ccccc32)c1=O

nearest known ligand 0.57

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
NLRP3 Q96P20 6/20 0.57
THRB P10828 2/20 0.45
MAPT P10636 3/20 0.44
POLB P06746 2/20 0.44
TP53 P04637 2/20 0.43
SMN1; SMN2 Q16637 1/20 0.41
RXFP1 Q9HBX9 2/20 0.41
KMT2A Q03164 1/20 0.41

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
SCHEMBL25633974 0.80 NLRP3 (0.65) NLRP3THRBMAPTTP53SMN1; SMN2
SCHEMBL25633281 0.80 NLRP3 (0.59) NLRP3THRBMAPTTP53SMN1; SMN2
SCHEMBL25633958 0.79 NLRP3 (0.62) NLRP3THRBMAPTTP53SMN1; SMN2
SCHEMBL25633971 0.79 NLRP3 (0.65) NLRP3THRBMAPTTP53SMN1; SMN2
SCHEMBL23950515 0.79 NLRP3 (0.52) NLRP3MAPTPOLBTP53RXFP1
SCHEMBL25633344 0.78 NLRP3 (0.61) NLRP3THRBMAPTTP53RXFP1
SCHEMBL25633373 0.76 THRB (0.76) NLRP3THRBTP53SMN1; SMN2RXFP1
SCHEMBL30455823 0.74 NLRP3 (0.55) NLRP3THRBMAPTTP53RXFP1
SCHEMBL25633290 0.74 NLRP3 (0.55) NLRP3THRBMAPTTP53RXFP1
SCHEMBL30073546 0.74 NLRP3 (0.59) NLRP3THRBMAPTTP53SMN1; SMN2

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 277/4885MAPT 542/4885

“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.