SCHEMBL27201386

SCHEMBL27201386

Nc1cc(N2CCNC(c3ccccc3Br)C2)nc(N)n1

nearest known ligand 0.48

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 6/20 0.48
HRH4 Q9H3N8 11/20 0.40
HRH3 Q9Y5N1 2/20 0.40
PDE10A Q9Y233 1/20 0.36
PRKCQ Q04759 2/20 0.36

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
SCHEMBL30885209 1.00 GSK3B (0.48) GSK3BHRH4HRH3PDE10APRKCQ
SCHEMBL30834137 0.87 HRH4 (0.50) GSK3BHRH4HRH3
SCHEMBL30834071 0.86 HRH4 (0.51) GSK3BHRH4PDE10APRKCQ
SCHEMBL30834104 0.86 GSK3B (0.47) GSK3BHRH4PDE10A
SCHEMBL27201671 0.86 HRH4 (0.51) GSK3BHRH4HRH3PDE10A
SCHEMBL30885236 0.86 HRH4 (0.51) GSK3BHRH4HRH3PDE10A
SCHEMBL30834090 0.84 NUDT1 (0.51) GSK3BHRH4HRH3
SCHEMBL30885211 0.83 HRH4 (0.38) GSK3BHRH4HRH3PDE10A
SCHEMBL27201436 0.83 HRH4 (0.38) GSK3BHRH4HRH3PDE10A
SCHEMBL30834122 0.83 HRH4 (0.36) GSK3BHRH4HRH3

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 4 patents. 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 claimed
WO-2024073502-A1 HETEROCYCLIC COMPOUNDS AS E3 LIGASE INHIBITORS ACCUTAR BIOTECHNOLOGY INC. (US) 2024-04-04 WO claimed
US-20240132464-A1 HETEROCYCLIC COMPOUNDS AS E3 LIGASE INHIBITORS ACCUTAR BIOTECHNOLOGY INC. (US) 2024-04-25 US disclosed
WO-2024073502-A1 HETEROCYCLIC COMPOUNDS AS E3 LIGASE INHIBITORS ACCUTAR BIOTECHNOLOGY INC. (US) 2024-04-04 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-20240132464-A1 HETEROCYCLIC COMPOUNDS AS E3 LIGASE INHIBITORS GID4, MDM2, XIAP GSK3B 95/4885HRH4 4074/4885HRH3 4300/4885

“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.