SCHEMBL7490646

SCHEMBL7490646

COc1ccc(C(=O)n2cc(C3=CCN(C)CC3)c3cc(F)ccc32)cc1

nearest known ligand 0.59

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 6/20 0.59
AKR1C3 P42330 2/20 0.48
SLC6A4 P31645 2/20 0.45
PKM P14618 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
AKR1C2 P52895 1/20 0.42
KMT2A Q03164 1/20 0.41

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 0.88 HTR6 (0.77) HTR6SLC6A4
SCHEMBL7490788 0.88 HTR6 (0.56) HTR6AKR1C3SLC6A4AKR1C2KMT2A
SCHEMBL7479822 0.86 HTR6 (0.80) HTR6SLC6A4KMT2A
SCHEMBL7490243 0.86 HTR6 (0.56) HTR6AKR1C3SLC6A4AKR1C2KMT2A
SCHEMBL7485121 0.84 HTR6 (0.54) HTR6AKR1C3SLC6A4AKR1C2
SCHEMBL7483235 0.83 HTR6 (0.53) HTR6AKR1C3SLC6A4
SCHEMBL7485130 0.83 HTR6 (0.59) HTR6SLC6A4KMT2A
SCHEMBL7482946 0.83 HTR6 (0.59) HTR6AKR1C3SLC6A4
SCHEMBL7868014 0.82 HTR6 (0.56) HTR6SLC6A4
SCHEMBL7484100 0.82 HTR6 (0.54) HTR6SLC6A4SMN1; SMN2KMT2A

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