SCHEMBL16148653

SCHEMBL16148653

COc1c(F)cccc1C(=O)N1CCCC(Nc2nccc(-c3ccccc3)n2)[C@@H]1C

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
HCRTR2 O43614 15/20 1.00
HCRTR1 O43613 6/20 0.51

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
SCHEMBL16031127 1.00 HCRTR2 (1.00) HCRTR2HCRTR1
SCHEMBL16031124 1.00 HCRTR2 (1.00) HCRTR2HCRTR1
SCHEMBL16031911 1.00 HCRTR2 (1.00) HCRTR2HCRTR1
SCHEMBL16078142 1.00 HCRTR2 (1.00) HCRTR2HCRTR1
SCHEMBL20144830 0.83 HCRTR2 (0.71) HCRTR2HCRTR1
SCHEMBL18697564 0.83 HCRTR2 (0.71) HCRTR2HCRTR1
SCHEMBL16078140 0.82 HCRTR2 (1.00) HCRTR2HCRTR1
SCHEMBL16030314 0.82 HCRTR2 (1.00) HCRTR2HCRTR1
SCHEMBL16031262 0.82 HCRTR2 (1.00) HCRTR2HCRTR1
SCHEMBL16149373 0.82 HCRTR2 (1.00) HCRTR2HCRTR1

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