SCHEMBL30834097

SCHEMBL30834097

CC(C)c1cc(N2CCO[C@H](c3ccccc3Br)C2)nc(N)n1

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HRH4 Q9H3N8 6/20 0.51
HRH3 Q9Y5N1 5/20 0.51
PIK3CB P42338 2/20 0.35
PIK3CA P42336 1/20 0.35
CRHBP P24387 1/20 0.35
CRHR2 Q13324 1/20 0.35
CYP1A2 P05177 2/20 0.34
CYP2D6 P10635 2/20 0.34
GSK3B P49841 2/20 0.34
CDK1 P06493 1/20 0.34
CDK2 P24941 1/20 0.34
PDE10A Q9Y233 1/20 0.34

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
SCHEMBL30834128 0.86 HRH4 (0.40) HRH4HRH3PIK3CBPIK3CACRHBP
SCHEMBL30834144 0.83 HRH4 (0.48) HRH4HRH3PIK3CBPIK3CACYP1A2
SCHEMBL30834116 0.80 HRH4 (0.52) HRH4HRH3
SCHEMBL30834094 0.80 NUDT1 (0.51) HRH4HRH3PIK3CBPDE10A
SCHEMBL27201607 0.79 HRH4 (0.60) HRH4HRH3
SCHEMBL30885220 0.79 HRH4 (0.60) HRH4HRH3
SCHEMBL27201671 0.79 HRH4 (0.51) HRH4HRH3GSK3BPDE10A
SCHEMBL30885236 0.79 HRH4 (0.51) HRH4HRH3GSK3BPDE10A
SCHEMBL30885293 0.78 HRH4 (0.49) HRH4HRH3GSK3B
SCHEMBL27201299 0.78 HRH4 (0.49) HRH4HRH3GSK3B

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 HRH4 4074/4885HRH3 4300/4885PIK3CB 615/4885

“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.