SCHEMBL30834087

SCHEMBL30834087

CNc1cc(N2CCC[C@H](c3ccccc3Br)C2)nc(N)n1

nearest known ligand 0.55

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
NUDT1 P36639 5/20 0.55
HRH4 Q9H3N8 14/20 0.45
KCNH2 Q12809 1/20 0.41
HRH3 Q9Y5N1 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
SCHEMBL30834118 0.88 NUDT1 (0.39) NUDT1HRH4
SCHEMBL30834246 0.83 HRH4 (0.46) HRH4
SCHEMBL27201384 0.83 HRH4 (0.46) HRH4
SCHEMBL27201312 0.81 NUDT1 (0.50) NUDT1HRH4KCNH2HRH3
SCHEMBL30885309 0.81 NUDT1 (0.50) NUDT1HRH4KCNH2HRH3
SCHEMBL30834108 0.81 NUDT1 (0.49) NUDT1HRH4KCNH2HRH3
SCHEMBL27201395 0.77 NUDT1 (0.56) NUDT1HRH4KCNH2HRH3
SCHEMBL30885292 0.77 NUDT1 (0.56) NUDT1HRH4KCNH2HRH3
SCHEMBL30834160 0.77 NUDT1 (0.50) NUDT1HRH4KCNH2HRH3
SCHEMBL30885305 0.77 NUDT1 (0.50) NUDT1HRH4KCNH2HRH3

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 NUDT1 3459/4885HRH4 4074/4885KCNH2 4840/4885

“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.