SCHEMBL20144800

SCHEMBL20144800

O=C(c1cccc(F)c1-c1ncco1)N1CCCC(Oc2ccc(Cl)cn2)C1

nearest known ligand 0.51

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HCRTR2 O43614 16/20 0.51
HCRTR1 O43613 16/20 0.51
MGLL Q99685 1/20 0.40

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
SCHEMBL18697741 1.00 HCRTR2 (0.51) HCRTR2HCRTR1MGLL
SCHEMBL20144992 0.90 HCRTR2 (0.51) HCRTR2HCRTR1MGLL
SCHEMBL20145044 0.90 HCRTR2 (0.51) HCRTR2HCRTR1MGLL
SCHEMBL20144796 0.89 HCRTR1 (0.65) HCRTR2HCRTR1
SCHEMBL20145154 0.86 HCRTR1 (0.64) HCRTR2HCRTR1
SCHEMBL18697749 0.85 HCRTR1 (0.62) HCRTR2HCRTR1
SCHEMBL20145021 0.85 HCRTR1 (0.62) HCRTR2HCRTR1
SCHEMBL16148824 0.82 HCRTR1 (0.62) HCRTR2HCRTR1
SCHEMBL20144935 0.81 HCRTR1 (0.54) HCRTR2HCRTR1
SCHEMBL20145071 0.80 HCRTR1 (0.54) 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