SCHEMBL7477833

SCHEMBL7477833

CN1CC=C(c2cn(C(=O)c3c(Cl)cccc3Cl)c3ccc(OC4CCCCC4)cc23)CC1

nearest known ligand 0.48

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 8/20 0.48
SLC6A4 P31645 1/20 0.37
ACSL1 P33121 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
HRH1 P35367 1/20 0.36
CCR3 P51677 1/20 0.36

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
SCHEMBL7486082 0.91 HTR6 (0.49) HTR6SLC6A4KMT2AHRH1CCR3
SCHEMBL7485121 0.85 HTR6 (0.54) HTR6SLC6A4
SCHEMBL7483235 0.84 HTR6 (0.53) HTR6SLC6A4
SCHEMBL7488142 0.84 HTR6 (0.50) HTR6SLC6A4
SCHEMBL7485600 0.81 HTR6 (0.55) HTR6SLC6A4
SCHEMBL7485143 0.79 HTR6 (0.52) HTR6
SCHEMBL4670820 0.76 HTR6 (0.55) HTR6
SCHEMBL4674840 0.76 HTR6 (0.55) HTR6SLC6A4
SCHEMBL2063673 0.76 HTR6 (0.55) HTR6
SCHEMBL7486142 0.76 HTR6 (0.66) HTR6

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1173432-A1 PIPERIDINE-INDOLE COMPOUNDS HAVING 5-HT6 AFFINITY NPS Allelix Corp. (CA) 2002-01-23 EP claimed
WO-2000063203-A1 PIPERIDINE-INDOLE COMPOUNDS HAVING 5-HT6 AFFINITY ALLELIX BIOPHARMACEUTICALS INC. (CA) 2000-10-26 WO claimed
EP-1173432-A1 PIPERIDINE-INDOLE COMPOUNDS HAVING 5-HT6 AFFINITY NPS Allelix Corp. (CA) 2002-01-23 EP disclosed
WO-2000063203-A1 PIPERIDINE-INDOLE COMPOUNDS HAVING 5-HT6 AFFINITY ALLELIX BIOPHARMACEUTICALS INC. (CA) 2000-10-26 WO disclosed
US-6133287-A SEROTONIN 5-HT6 RECEPTOR ANTAGONISTS; CENTRAL NERVOUS SYSTEM DISORDERS, E.G., PSYCHOSIS, SCHIZOPHRENIA, MANIC DEPRESSION, DEPRESSION, MEMORY DISTURBANCES, PARKINSONISM, AMYLOTROPHIC LATERAL SCLEROSIS, ALZHEIMER'S AND HUNTINGTON'S DISEASE ALLELIX BIOPHARMACEUTICALS INC. (CA) 2000-10-17 US disclosed