SCHEMBL30885282

SCHEMBL30885282

Cc1cc(N2CCCC(c3cnc4ccccn34)C2)nc(N)n1

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
IRAK4 Q9NWZ3 2/20 0.46
CRHBP P24387 2/20 0.45
CRHR2 Q13324 2/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
HRH4 Q9H3N8 7/20 0.44
MAPT P10636 1/20 0.43
GFER P55789 1/20 0.43
HRH3 Q9Y5N1 4/20 0.42
PDE2A O00408 1/20 0.41
MAP4K4 O95819 2/20 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
SCHEMBL27201324 1.00 IRAK4 (0.46) IRAK4CRHBPCRHR2SMN1; SMN2HRH4
SCHEMBL30834117 0.90 IRAK4 (0.47) IRAK4HRH4HRH3MAP4K4
SCHEMBL27201279 0.88 HRH4 (0.54) IRAK4HRH4HRH3
SCHEMBL30834150 0.88 HRH4 (0.54) IRAK4HRH4HRH3
SCHEMBL27201461 0.87 HRH4 (0.49) IRAK4HRH4HRH3
SCHEMBL30885222 0.87 HRH4 (0.49) IRAK4HRH4HRH3
SCHEMBL30834156 0.85 NUDT1 (0.53) IRAK4HRH4
SCHEMBL27201285 0.85 NUDT1 (0.53) IRAK4HRH4
SCHEMBL30834281 0.83 IRAK4 (0.42) IRAK4HRH4HRH3
SCHEMBL27201272 0.83 IRAK4 (0.42) IRAK4HRH4HRH3

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-20240132464-A1 HETEROCYCLIC COMPOUNDS AS E3 LIGASE INHIBITORS ACCUTAR BIOTECHNOLOGY INC. (US) 2024-04-25 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-20240132464-A1 HETEROCYCLIC COMPOUNDS AS E3 LIGASE INHIBITORS GID4, MDM2, XIAP IRAK4 1128/4885CRHBP 3574/4885CRHR2 4631/4885

“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.