SCHEMBL27201355

SCHEMBL27201355

CC(C)c1cc(N2CCCC(c3nn(C)c4ccccc34)C2)nc(N)n1

nearest known ligand 0.50

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HRH4 Q9H3N8 14/20 0.50
HRH3 Q9Y5N1 5/20 0.50
PDE10A Q9Y233 1/20 0.37
HTR1B P28222 1/20 0.36
HTR2B P41595 1/20 0.36
GPR65 Q8IYL9 1/20 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
SCHEMBL30885313 1.00 HRH4 (0.50) HRH4HRH3PDE10AHTR1BHTR2B
SCHEMBL27201255 0.83 HRH4 (0.50) HRH4HRH3HTR1BHTR2BGPR65
SCHEMBL30834080 0.83 HRH4 (0.50) HRH4HRH3HTR1BHTR2BGPR65
SCHEMBL30885213 0.81 HRH3 (0.50) HRH4HRH3
SCHEMBL27201453 0.81 HRH3 (0.50) HRH4HRH3
SCHEMBL30834195 0.80 HRH4 (0.49) HRH4HRH3PDE10A
SCHEMBL27201519 0.80 HRH4 (0.49) HRH4HRH3PDE10A
SCHEMBL30834227 0.77 HRH3 (0.50) HRH4HRH3
SCHEMBL30885294 0.77 HRH4 (0.50) HRH4HRH3PDE10A
SCHEMBL27201305 0.77 HRH3 (0.50) 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 4074/4885HRH3 4300/4885PDE10A 4389/4885

“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.