SCHEMBL7933387

SCHEMBL7933387

CCCCCC1CNCCN1c1cocn1

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 6/20 0.44
SLC6A4 P31645 6/20 0.44
SLC6A3 Q01959 6/20 0.44
CYP2D6 P10635 5/20 0.44
HTR2C P28335 8/20 0.37
HTR2A P28223 7/20 0.37
HTR2B P41595 6/20 0.37
TAAR1 Q96RJ0 1/20 0.36
TLR9 Q9NR96 1/20 0.33
TLR8 Q9NR97 1/20 0.33
TLR7 Q9NYK1 1/20 0.33

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
SCHEMBL14255979 0.80 SLC6A2 (0.46) SLC6A2SLC6A4SLC6A3CYP2D6HTR2C
SCHEMBL14255978 0.77 CHRNA7 (0.37) SLC6A2SLC6A4SLC6A3CYP2D6HTR2C
SCHEMBL5330905 0.76 SLC6A2 (0.47) SLC6A2SLC6A4SLC6A3CYP2D6HTR2C
SCHEMBL14255976 0.75 SLC6A4 (0.61) SLC6A2SLC6A4SLC6A3CYP2D6HTR2C
SCHEMBL14265356 0.75 SLC6A4 (0.61) SLC6A2SLC6A4SLC6A3CYP2D6HTR2C
SCHEMBL3611689 0.73 SLC6A2 (0.45) SLC6A2SLC6A4SLC6A3CYP2D6HTR2C
SCHEMBL660942 0.73 CYP2D6 (0.47) SLC6A2SLC6A4SLC6A3CYP2D6HTR2C
SCHEMBL6220026 0.72 SLC6A2 (0.61) SLC6A2SLC6A4SLC6A3CYP2D6TAAR1
SCHEMBL7416026 0.69 SLC6A2 (0.46) SLC6A2SLC6A4SLC6A3CYP2D6HTR2C
SCHEMBL10623387 0.68 SLC6A2 (0.47) SLC6A2SLC6A4SLC6A3CYP2D6HTR2C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023144764-A1 BENZOISOTHIAZOLE AND BENZOISOXAZOLE COMPOUNDS FOR THE TREATMENT OF MENTAL DISORDERS SUVEN LIFE SCIENCES LIMITED (IN) 2023-08-03 WO disclosed
US-6242448-B1 Trisubstituted-oxazole derivatives as serotonin ligands AMERICAN HOME PRODUCTS CORPORATION 2001-06-05 US disclosed