SCHEMBL24529324

SCHEMBL24529324

CCN(C(N)=O)[C@H](C)c1cccc(-c2cn3ccnc3c(OC)n2)c1

nearest known ligand 0.68

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ HCRTR2 O43614 11/20 0.68
▸ SYK P43405 5/20 0.45
▸ CD63 P08962 1/20 0.41
▸ AURKA O14965 4/20 0.41

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
SCHEMBL27179411 0.86 HCRTR2 (0.75) HCRTR2SYKAURKA
SCHEMBL24529218 0.86 HCRTR2 (0.75) HCRTR2SYKAURKA
SCHEMBL27181609 0.84 HCRTR2 (0.84) HCRTR2SYKAURKA
SCHEMBL27181611 0.84 HCRTR2 (0.84) HCRTR2SYKAURKA
SCHEMBL24529146 0.84 HCRTR2 (0.72) HCRTR2SYKAURKA
SCHEMBL29723672 0.84 HCRTR2 (0.68) HCRTR2SYKAURKA
SCHEMBL27180869 0.84 HCRTR2 (0.68) HCRTR2SYKAURKA
SCHEMBL24529540 0.84 HCRTR2 (0.68) HCRTR2SYKAURKA
SCHEMBL29723568 0.84 HCRTR2 (0.72) HCRTR2SYKAURKA
SCHEMBL27179807 0.84 HCRTR2 (0.72) HCRTR2SYKAURKA

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022132696-A1 UREA OREXIN RECEPTOR AGONISTS MERCK SHARP & DOHME CORP. (US) 2022-06-23 — — WO disclosed
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