SCHEMBL16148477

SCHEMBL16148477

Cc1ccc(C(=O)N2CCCC(Nc3nccc(C(F)(F)F)n3)[C@@H]2C)c(-n2ccnn2)n1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
HCRTR1 O43613 19/20 1.00
HCRTR2 O43614 15/20 1.00

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
SCHEMBL16078113 1.00 HCRTR1 (1.00) HCRTR1HCRTR2
SCHEMBL16030711 1.00 HCRTR1 (1.00) HCRTR1HCRTR2
SCHEMBL16030708 1.00 HCRTR1 (1.00) HCRTR1HCRTR2
SCHEMBL17521759 0.89 HCRTR1 (0.80) HCRTR1HCRTR2
SCHEMBL16032414 0.88 HCRTR1 (1.00) HCRTR1HCRTR2
SCHEMBL16031264 0.87 HCRTR1 (1.00) HCRTR1HCRTR2
SCHEMBL16031952 0.84 HCRTR1 (1.00) HCRTR1HCRTR2
SCHEMBL20144956 0.83 HCRTR1 (0.72) HCRTR1HCRTR2
SCHEMBL16031180 0.77 HCRTR1 (1.00) HCRTR1HCRTR2
SCHEMBL16032043 0.75 HCRTR1 (1.00) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2970207-A1 SUBSTITUTED PIPERIDINE COMPOUNDS AND THEIR USE AS OREXIN RECEPTOR MODULATORS Janssen Pharmaceutica, N.V. (BE) 2016-01-20 EP disclosed
WO-2014165065-A1 SUBSTITUTED PIPERIDINE COMPOUNDS AND THEIR USE AS OREXIN RECEPTOR MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2014-10-09 WO disclosed