SCHEMBL1035573

SCHEMBL1035573

COc1ccc(C2CN(C)Cc3cc(OCCCN4CCN(C(=O)O)CC4)ccc32)cc1

nearest known ligand 0.86

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 20/20 0.86
HRH3 Q9Y5N1 20/20 0.86

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
SCHEMBL1032495 0.93 SLC6A4 (1.00) SLC6A4HRH3
SCHEMBL1033191 0.90 SLC6A4 (0.90) SLC6A4HRH3
SCHEMBL1035381 0.90 SLC6A4 (0.82) SLC6A4HRH3
SCHEMBL1035488 0.90 SLC6A4 (0.82) SLC6A4HRH3
SCHEMBL1035464 0.90 SLC6A4 (1.00) SLC6A4HRH3
SCHEMBL1039026 0.89 SLC6A4 (0.79) SLC6A4HRH3
SCHEMBL1036800 0.89 SLC6A4 (0.79) SLC6A4HRH3
SCHEMBL1038596 0.89 SLC6A4 (0.83) SLC6A4HRH3
SCHEMBL1032995 0.88 SLC6A4 (1.00) SLC6A4HRH3
SCHEMBL1037259 0.88 SLC6A4 (0.85) SLC6A4HRH3

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-1831173-B1 TETRAHYDROISOQUINOLINE COMPOUNDS FOR TREATMENT OF CNS DISORDERS JANSSEN PHARMACEUTICA NV (BE) 2011-01-26 EP claimed