SCHEMBL7484100

SCHEMBL7484100

CN1CC=C(c2cn(C(=O)c3ccc4c(c3)OCO4)c3ccc(F)cc23)CC1

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 6/20 0.54
SLC6A4 P31645 1/20 0.43
TSHR P16473 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
ALDH1A1 P00352 3/20 0.41
SCD O00767 1/20 0.41
SCD5 Q86SK9 1/20 0.41
F2 P00734 1/20 0.41
MAPK1 P28482 1/20 0.41
KMT2A Q03164 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
HPGD P15428 2/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
SIGMAR1 Q99720 1/20 0.39

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
SCHEMBL4674250 0.84 HTR6 (0.77) HTR6SLC6A4
SCHEMBL7490646 0.82 HTR6 (0.59) HTR6SLC6A4KMT2ASMN1; SMN2
SCHEMBL7868014 0.80 HTR6 (0.56) HTR6SLC6A4
SCHEMBL7482946 0.79 HTR6 (0.59) HTR6SLC6A4
SCHEMBL7484905 0.78 HTR6 (0.83) HTR6ALDH1A1KMT2A
SCHEMBL7485600 0.77 HTR6 (0.55) HTR6SLC6A4
SCHEMBL7485451 0.77 HTR6 (0.57) HTR6SLC6A4ALDH1A1KMT2A
SCHEMBL7483404 0.77 HTR6 (0.54) HTR6SLC6A4L3MBTL1
SCHEMBL7490243 0.76 HTR6 (0.56) HTR6SLC6A4KMT2A
SCHEMBL9463103 0.75 HTR6 (0.50) HTR6SLC6A4

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