SCHEMBL6794870

SCHEMBL6794870

COc1ccc(CNC(=O)C2(CCCCN3CCN(c4cccc(OC)n4)CC3)c3ccccc3-c3ccccc32)cc1

nearest known ligand 0.54

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 15/20 0.54
HTR2A P28223 2/20 0.54
DRD3 P35462 2/20 0.54
HTR2C P28335 1/20 0.51
HTR7 P34969 12/20 0.46
DRD2 P14416 5/20 0.46
HTR6 P50406 5/20 0.46
HTT P42858 1/20 0.42

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
SCHEMBL6795245 0.93 HTR1A (0.53) HTR1AHTR2ADRD3HTR2CHTR7
SCHEMBL7723383 0.89 HTR1A (0.53) HTR1AHTR2ADRD3HTR2CHTR7
SCHEMBL6770007 0.88 SLC6A2 (0.49) HTR1AHTR2ADRD3HTR2CHTR7
SCHEMBL7118283 0.86 DRD3 (0.55) HTR1AHTR2ADRD3HTR2C
SCHEMBL6770740 0.86 HTR1A (0.49) HTR1AHTR2ADRD3HTR7DRD2
SCHEMBL6793155 0.85 MTTP (0.47) HTR1AHTR2ADRD3HTR2C
SCHEMBL6771329 0.83 ALDH1A1 (0.49) HTR1AHTR7DRD2HTR6
SCHEMBL6769811 0.82 DRD3 (0.51) HTR1AHTR2ADRD3HTR2CDRD2
SCHEMBL6793499 0.82 HTR1A (0.51) HTR1AHTR2ADRD3HTR2CHTR7
SCHEMBL6769569 0.82 RAB9A (0.55) HTR1AHTR7DRD2HTR6

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
US-6818644-B1 FLUORENE-9-CARBOXYLIC AMIDES; INHIBITORS OF MICROSOMAL TRIGLYSERIDE-TRANSFER PROTEIN (MTP); ANTILIPEMIC AGENTS; ATHEROSCLEROSIS, DIABETES, EATING DISORDERS, AND PANCREATITIS BOEHRINGER INGELHEIM PHARM GMBH & CO, KG (DE) 2004-11-16 US disclosed