SCHEMBL27201423

SCHEMBL27201423

Nc1cc(N2CCCC(c3n[nH]c4ccccc34)C2)nc(N)n1

nearest known ligand 0.43

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HRH4 Q9H3N8 10/20 0.43
PDPK1 O15530 10/20 0.42
AURKB Q96GD4 7/20 0.42
AURKA O14965 6/20 0.42
ROCK1 Q13464 3/20 0.42
HRH3 Q9Y5N1 2/20 0.37

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
SCHEMBL30834081 1.00 HRH4 (0.43) HRH4PDPK1AURKBAURKAROCK1
SCHEMBL27201453 0.87 HRH3 (0.50) HRH4PDPK1AURKBAURKAROCK1
SCHEMBL30885213 0.87 HRH3 (0.50) HRH4PDPK1AURKBAURKAROCK1
SCHEMBL27201396 0.81 KDM4E (0.48) HRH4
SCHEMBL30834095 0.81 KDM4E (0.48) HRH4
SCHEMBL27201397 0.74 MAP4K4 (0.58) HRH4HRH3
SCHEMBL30834067 0.74 MAP4K4 (0.58) HRH4HRH3
SCHEMBL30834276 0.74 HRH4 (0.42) HRH4HRH3
SCHEMBL27201295 0.74 HRH4 (0.42) HRH4HRH3
SCHEMBL27201362 0.74 HRH4 (0.42) HRH4HRH3

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 2 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
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 HRH4 4074/4885PDPK1 400/4885AURKB 2416/4885

“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.