SCHEMBL22355735

SCHEMBL22355735

COC(=O)N1CC[C@H](C)[C@@H]1CO[C@H]1CC[C@@H](c2ccccc2)CC1

nearest known ligand 0.67

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ HCRTR2 O43614 20/20 0.67

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
SCHEMBL22355835 1.00 HCRTR2 (0.67) HCRTR2
SCHEMBL22355825 1.00 HCRTR2 (0.67) HCRTR2
SCHEMBL22355736 0.88 HCRTR2 (0.64) HCRTR2
SCHEMBL22355839 0.88 HCRTR2 (0.57) HCRTR2
SCHEMBL24411540 0.88 HCRTR2 (0.66) HCRTR2
SCHEMBL22355746 0.88 HCRTR2 (0.66) HCRTR2
SCHEMBL22355894 0.88 HCRTR2 (0.66) HCRTR2
SCHEMBL22064467 0.87 HCRTR2 (0.70) HCRTR2
SCHEMBL22355742 0.86 HCRTR2 (0.66) HCRTR2
SCHEMBL22355744 0.86 HCRTR2 (0.66) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2020167701-A1 PYRROLIDINE OREXIN RECEPTOR AGONISTS MERCK SHARP & DOHME CORP. (US) 2020-08-20 — — WO disclosed
Send feedback