SCHEMBL24529353

SCHEMBL24529353

CCNC(C)c1ccnc(-c2cn3ccnc3c(OC)n2)n1

nearest known ligand 0.55

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ HCRTR2 O43614 10/20 0.55
▸ AURKA O14965 3/20 0.36
▸ PDE3B Q13370 1/20 0.33
▸ PDE3A Q14432 1/20 0.33
▸ NTRK1 P04629 1/20 0.32
▸ SYK P43405 2/20 0.32
▸ TMIGD3 P0DMS9 2/20 0.32

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
SCHEMBL24529261 0.84 HCRTR2 (0.44) HCRTR2AURKASYK
SCHEMBL27181187 0.84 HCRTR2 (0.44) HCRTR2AURKASYK
SCHEMBL29723688 0.84 HCRTR2 (0.44) HCRTR2AURKASYK
SCHEMBL24529568 0.78 HCRTR2 (0.57) HCRTR2PDE3BPDE3ANTRK1SYK
SCHEMBL24529266 0.77 HCRTR2 (0.55) HCRTR2AURKASYK
SCHEMBL27180734 0.77 HCRTR2 (0.55) HCRTR2AURKASYK
SCHEMBL24529416 0.75 HCRTR2 (0.40) HCRTR2AURKAPDE3BPDE3ANTRK1
SCHEMBL24387026 0.73 HCRTR2 (0.34) HCRTR2PDE3BPDE3ASYK
SCHEMBL29723758 0.73 HCRTR2 (0.46) HCRTR2AURKAPDE3BPDE3ASYK
SCHEMBL24387028 0.72 HCRTR2 (0.32) HCRTR2

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
EP-4262788-B1 UREA OREXIN RECEPTOR AGONISTS MERCK SHARP & DOHME LLC (US) 2026-01-21 — — EP disclosed
US-20240101555-A1 UREA OREXIN RECEPTOR AGONISTS MERCK SHARP & DOHME LLC (US) 2024-03-28 — — US disclosed
WO-2022132696-A1 UREA OREXIN RECEPTOR AGONISTS MERCK SHARP & DOHME CORP. (US) 2022-06-23 — — 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-20240101555-A1 UREA OREXIN RECEPTOR AGONISTS HCRTR1, HCRTR2, UTS2R HCRTR2 2/4885AURKA 4623/4885PDE3B 1550/4885

“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.

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