SCHEMBL31372467

SCHEMBL31372467

C[C@@H]1CN(C(=O)OC(C)(C)C)[C@H](CNc2cnc(C(F)(F)F)cn2)[C@H](C)O1

nearest known ligand 0.44

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
HCRTR1 O43613 20/20 0.44
HCRTR2 O43614 1/20 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
SCHEMBL31372534 1.00 HCRTR1 (0.44) HCRTR1HCRTR2
SCHEMBL31372481 0.86 HCRTR1 (0.41) HCRTR1HCRTR2
SCHEMBL31372673 0.86 HCRTR1 (0.47) HCRTR1HCRTR2
SCHEMBL31372674 0.86 HCRTR1 (0.41) HCRTR1HCRTR2
SCHEMBL31372477 0.86 HCRTR1 (0.47) HCRTR1HCRTR2
SCHEMBL31372550 0.84 HCRTR1 (0.34) HCRTR1HCRTR2
SCHEMBL31336652 0.84 HCRTR1 (0.47) HCRTR1HCRTR2
SCHEMBL31372733 0.83 HCRTR1 (0.43) HCRTR1HCRTR2
SCHEMBL31372607 0.83 HCRTR1 (0.43) HCRTR1HCRTR2
SCHEMBL31372630 0.82 HCRTR1 (0.44) HCRTR1HCRTR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4688155-A1 MORPHOLINE OREXIN RECEPTOR ANTAGONISTS Bial-Portela & CA, S.A. (PT) 2026-02-11 EP claimed
WO-2025023852-A1 MORPHOLINE OREXIN RECEPTOR ANTAGONISTS BIAL - PORTELA & CA., S.A. (PT) 2025-01-30 WO claimed
EP-4688155-A1 MORPHOLINE OREXIN RECEPTOR ANTAGONISTS Bial-Portela & CA, S.A. (PT) 2026-02-11 EP disclosed
WO-2025023852-A1 MORPHOLINE OREXIN RECEPTOR ANTAGONISTS BIAL - PORTELA & CA., S.A. (PT) 2025-01-30 WO disclosed