SCHEMBL5336832

SCHEMBL5336832

Cc1cccc(-c2noc(C3CCCN3C(=O)c3ccc(C)s3)n2)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 14/20 0.73
HCRTR1 O43613 1/20 0.66
HCRTR2 O43614 1/20 0.66

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
SCHEMBL5328125 0.91 HCRTR1 (0.74) GRM5HCRTR1HCRTR2
SCHEMBL2723336 0.87 GRM5 (0.71) GRM5HCRTR1HCRTR2
SCHEMBL2721716 0.86 GRM5 (0.61) GRM5HCRTR1HCRTR2
SCHEMBL2723557 0.84 GRM5 (1.00) GRM5HCRTR1HCRTR2
SCHEMBL5332345 0.83 GRM5 (0.71) GRM5HCRTR1HCRTR2
SCHEMBL5328028 0.81 GRM5 (1.00) GRM5
SCHEMBL5310239 0.81 GRM5 (1.00) GRM5
SCHEMBL2722549 0.80 GRM5 (0.73) GRM5HCRTR1HCRTR2
SCHEMBL2721615 0.80 GRM5 (0.75) GRM5HCRTR1HCRTR2
SCHEMBL5339372 0.80 GRM5 (0.71) GRM5HCRTR1HCRTR2

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
WO-2007039781-A2 NEW COMPOUNDS Richter Gedeon Vegyészeti Gyár Rt. (HU) 2007-04-12 WO claimed
WO-2007039781-A2 NEW COMPOUNDS Richter Gedeon Vegyészeti Gyár Rt. (HU) 2007-04-12 WO disclosed