SCHEMBL20145187

SCHEMBL20145187

CNC1CCCN(C(=O)c2ccc(C)cc2-n2nccn2)C1

nearest known ligand 0.50

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HCRTR1 O43613 16/20 0.50
HCRTR2 O43614 15/20 0.50
GFER P55789 1/20 0.47
KMT2A Q03164 1/20 0.47

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
SCHEMBL20144988 0.83 HCRTR1 (0.68) HCRTR1HCRTR2GFERKMT2A
SCHEMBL18697535 0.83 HCRTR1 (0.68) HCRTR1HCRTR2GFERKMT2A
SCHEMBL20144828 0.83 HCRTR1 (0.69) HCRTR1HCRTR2GFER
SCHEMBL18697656 0.83 HCRTR1 (0.69) HCRTR1HCRTR2GFER
SCHEMBL20144892 0.82 HCRTR1 (0.69) HCRTR1HCRTR2GFERKMT2A
SCHEMBL20145252 0.82 HCRTR1 (0.69) HCRTR1HCRTR2GFERKMT2A
SCHEMBL20144982 0.81 HCRTR1 (0.70) HCRTR1HCRTR2
SCHEMBL20144810 0.81 HCRTR1 (0.70) HCRTR1HCRTR2
SCHEMBL20144860 0.80 HCRTR1 (0.70) HCRTR1HCRTR2
SCHEMBL19315136 0.79 HCRTR2 (0.60) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2970207-B1 SUBSTITUTED PIPERIDINE COMPOUNDS AND THEIR USE AS OREXIN RECEPTOR MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2018-05-16 EP disclosed