SCHEMBL3417684

SCHEMBL3417684

Cc1cccc(-c2sc(C)nc2C(=O)N2C[C@@H]3C[C@@H]3[C@H]2CNC(=O)Oc2cn(C)nc2C)c1

nearest known ligand 0.51

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
HCRTR1 O43613 20/20 0.51
HCRTR2 O43614 13/20 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
SCHEMBL3415865 0.93 HCRTR1 (0.45) HCRTR1HCRTR2
SCHEMBL1338268 0.88 HCRTR1 (0.57) HCRTR1HCRTR2
SCHEMBL3414952 0.86 HCRTR1 (0.48) HCRTR1HCRTR2
SCHEMBL3410134 0.86 HCRTR1 (0.50) HCRTR1HCRTR2
SCHEMBL3418166 0.86 HCRTR1 (0.50) HCRTR1HCRTR2
SCHEMBL3415794 0.85 HCRTR1 (0.58) HCRTR1HCRTR2
SCHEMBL3417609 0.85 HCRTR1 (0.49) HCRTR1HCRTR2
SCHEMBL3418289 0.85 HCRTR1 (0.49) HCRTR1HCRTR2
SCHEMBL2959420 0.85 HCRTR1 (0.49) HCRTR1HCRTR2
SCHEMBL3417936 0.85 HCRTR1 (0.49) 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-2185512-B1 TRANS-3-AZA-BICYCLO[3.1.0]HEXANE DERIVATIVES ACTELION PHARMACEUTICALS LTD (CH) 2010-12-29 EP claimed