SCHEMBL20144959

SCHEMBL20144959

COc1c(F)cccc1C(=O)N1CCCC(Nc2nc3cc(Cl)ccc3o2)[C@H]1C

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
HCRTR2 O43614 14/20 1.00
HCRTR1 O43613 10/20 0.69

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
SCHEMBL16033115 1.00 HCRTR2 (1.00) HCRTR2HCRTR1
SCHEMBL16078130 1.00 HCRTR2 (1.00) HCRTR2HCRTR1
SCHEMBL16030414 1.00 HCRTR2 (1.00) HCRTR2HCRTR1
SCHEMBL16030416 1.00 HCRTR2 (1.00) HCRTR2HCRTR1
SCHEMBL20144811 0.83 HCRTR2 (0.72) HCRTR2HCRTR1
SCHEMBL16030743 0.82 HCRTR2 (1.00) HCRTR2HCRTR1
SCHEMBL16031766 0.82 HCRTR2 (1.00) HCRTR2HCRTR1
SCHEMBL16078143 0.82 HCRTR2 (1.00) HCRTR2HCRTR1
SCHEMBL16030745 0.82 HCRTR2 (1.00) HCRTR2HCRTR1
SCHEMBL20145213 0.82 HCRTR2 (0.73) 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 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