SCHEMBL27201417

SCHEMBL27201417

Nc1nc(N2CCCC(c3ccn[nH]3)C2)c2[nH]ccc2n1

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAP4K4 O95819 6/20 0.52
LRRK2 Q5S007 1/20 0.43
HRH4 Q9H3N8 3/20 0.36
KCNH2 Q12809 2/20 0.36
HRH3 Q9Y5N1 2/20 0.36
NPY5R Q15761 1/20 0.35
DPP4 P27487 1/20 0.35
PIK3CA P42336 1/20 0.34
MTOR P42345 1/20 0.34
DOT1L Q8TEK3 1/20 0.34
BTK Q06187 5/20 0.33
JAK3 P52333 1/20 0.33

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
SCHEMBL27201481 0.83 HRH4 (0.53) MAP4K4LRRK2HRH4DOT1LBTK
SCHEMBL30885318 0.83 HRH4 (0.53) MAP4K4LRRK2HRH4DOT1LBTK
SCHEMBL30834277 0.82 MAP4K4 (0.51) MAP4K4LRRK2HRH4PIK3CABTK
SCHEMBL27201438 0.82 MAP4K4 (0.51) MAP4K4LRRK2HRH4PIK3CABTK
SCHEMBL27201410 0.81 MAP4K4 (0.53) MAP4K4LRRK2HRH4KCNH2HRH3
SCHEMBL30885255 0.80 MAP4K4 (0.53) MAP4K4LRRK2HRH4KCNH2HRH3
SCHEMBL27201579 0.80 MAP4K4 (0.53) MAP4K4LRRK2HRH4KCNH2HRH3
SCHEMBL27201514 0.80 MAP4K4 (0.51) MAP4K4LRRK2HRH4KCNH2HRH3
SCHEMBL27201336 0.80 MAP4K4 (0.51) MAP4K4LRRK2HRH4KCNH2HRH3
SCHEMBL30885232 0.78 MAP4K4 (0.51) MAP4K4LRRK2HRH4DPP4PIK3CA

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 3 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

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 MAP4K4 1878/4885LRRK2 209/4885HRH4 4074/4885

“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.