SCHEMBL24529318

SCHEMBL24529318

CCN[C@H](C)c1cccc(-c2cc(OC)c3nccn3c2)c1

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ SYK P43405 7/20 0.39
▸ CD63 P08962 1/20 0.39
▸ HCRTR2 O43614 7/20 0.38
▸ CASR P41180 2/20 0.36
▸ OPRK1 P41145 1/20 0.36
▸ AURKA O14965 1/20 0.36
▸ HDAC6 Q9UBN7 1/20 0.35
▸ ATP1A1 P05023 1/20 0.34
▸ ATP1B1 P05026 1/20 0.34
▸ ATP1A3 P13637 1/20 0.34
▸ ATP1B2 P14415 1/20 0.34
▸ ATP1A2 P50993 1/20 0.34
▸ ATP1B3 P54709 1/20 0.34
▸ FXYD2 P54710 1/20 0.34
▸ ATP1A4 Q13733 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
SCHEMBL27181434 1.00 SYK (0.39) SYKCD63HCRTR2CASROPRK1
SCHEMBL27180720 0.89 HCRTR2 (0.35) SYKCD63HCRTR2OPRK1HDAC6
SCHEMBL29723821 0.89 HCRTR2 (0.35) SYKCD63HCRTR2OPRK1HDAC6
SCHEMBL24529205 0.89 HCRTR2 (0.35) SYKCD63HCRTR2OPRK1HDAC6
SCHEMBL24529266 0.81 HCRTR2 (0.55) SYKCD63HCRTR2AURKA
SCHEMBL27180734 0.81 HCRTR2 (0.55) SYKCD63HCRTR2AURKA
SCHEMBL24529325 0.80 HCRTR2 (0.54) SYKHCRTR2HDAC6
SCHEMBL27179410 0.80 HCRTR2 (0.54) SYKHCRTR2HDAC6
SCHEMBL24529531 0.79 HCRTR2 (0.52) HCRTR2OPRK1
SCHEMBL27179772 0.79 HCRTR2 (0.52) HCRTR2OPRK1

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 SYK 4422/4885CD63 4726/4885HCRTR2 2/4885

“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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