SCHEMBL1398552

SCHEMBL1398552

Cc1cccc(-c2sc(N)nc2C(=O)N2CC[C@H]2CNC(=O)c2c(C)nc3sccn23)c1

nearest known ligand 0.86

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
HCRTR1 O43613 19/20 0.86
HCRTR2 O43614 19/20 0.86

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
SCHEMBL1398521 0.93 HCRTR1 (0.86) HCRTR1HCRTR2
SCHEMBL1398588 0.93 HCRTR1 (0.86) HCRTR1HCRTR2
SCHEMBL1398721 0.93 HCRTR1 (0.86) HCRTR1HCRTR2
SCHEMBL1398745 0.93 HCRTR1 (1.00) HCRTR1HCRTR2
SCHEMBL4739234 0.88 HCRTR1 (0.68) HCRTR1HCRTR2
SCHEMBL4739920 0.88 HCRTR1 (0.69) HCRTR1HCRTR2
SCHEMBL4738336 0.88 HCRTR1 (0.68) HCRTR1HCRTR2
SCHEMBL4785147 0.87 HCRTR1 (0.68) HCRTR1HCRTR2
SCHEMBL3640876 0.86 HCRTR1 (0.66) HCRTR1HCRTR2
SCHEMBL1572210 0.86 HCRTR1 (0.88) 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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7994336-B2 Azetidine compounds as orexin receptor antagonists ACTELION PHARMACEUTICALS LTD. (CH) 2011-08-09 US claimed
EP-2069332-B1 AZETIDINE COMPOUNDS AS OREXIN RECEPTOR ANTAGONISTS ACTELION PHARMACEUTICALS LTD (CH) 2011-03-02 EP claimed
US-7994336-B2 Azetidine compounds as orexin receptor antagonists ACTELION PHARMACEUTICALS LTD. (CH) 2011-08-09 US disclosed
EP-2069332-B1 AZETIDINE COMPOUNDS AS OREXIN RECEPTOR ANTAGONISTS ACTELION PHARMACEUTICALS LTD (CH) 2011-03-02 EP disclosed
EP-1973960-B1 POLYESTER OLIGOMERS, METHODS OF MAKING, AND THERMOSETTING COMPOSITIONS FORMED THEREFROM SABIC INNOVATIVE PLASTICS IP (NL) 2011-03-02 EP disclosed
EP-1973960-A2 POLYESTER OLIGOMERS, METHODS OF MAKING, AND THERMOSETTING COMPOSITIONS FORMED THEREFROM GENERAL ELECTRIC COMPANY (US) 2008-10-01 EP disclosed
WO-2007081539-A2 POLYESTER OLIGOMERS, METHODS OF MAKING, AND THERMOSETTING COMPOSITIONS FORMED THEREFROM GENERAL ELECTRIC COMPANY (US) 2007-07-19 WO disclosed
US-20070155946-A1 Polyester oligomers, methods of making, and thermosetting compositions formed therefrom CITIBANK, N.A., AS COLLATERAL AGENT 2007-07-05 US disclosed