SCHEMBL11066546

SCHEMBL11066546

O=C1CCc2c(cccc2OCCCN2CCC(O)(c3ccccc3Cl)CC2)N1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 13/20 0.48
DRD3 P35462 5/20 0.45
DRD4 P21917 4/20 0.45
MAOA P21397 2/20 0.43
MAOB P27338 1/20 0.43
HTR1A P08908 2/20 0.43
HTR2A P28223 2/20 0.43
HTR3E A5X5Y0 1/20 0.43
MEN1 O00255 1/20 0.43
MLNR O43193 1/20 0.43
HTR3B O95264 1/20 0.43
ABCB11 O95342 1/20 0.43
ESR1 P03372 1/20 0.43
PGR P06401 1/20 0.43
ADRB2 P07550 1/20 0.43
CHRM2 P08172 1/20 0.43
ABCB1 P08183 1/20 0.43
ADRB1 P08588 1/20 0.43
ADRA2A P08913 1/20 0.43
ADORA3 P0DMS8 1/20 0.43

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
SCHEMBL11064027 0.91 DRD2 (0.48) DRD2DRD3DRD4MAOAMAOB
SCHEMBL11063753 0.89 DRD2 (0.44) DRD2DRD3DRD4MAOAMAOB
SCHEMBL11071740 0.86 HTR7 (0.50) DRD2DRD3DRD4MAOAMAOB
SCHEMBL11065769 0.86 DRD2 (0.58) DRD2DRD3DRD4HTR1AHTR2A
SCHEMBL11071128 0.85 DRD2 (0.48) DRD2DRD3DRD4MAOAMAOB
SCHEMBL11064990 0.84 DRD2 (0.51) DRD2DRD3DRD4MAOAMAOB
SCHEMBL11070967 0.83 DRD2 (0.53) DRD2DRD3DRD4MAOAMAOB
SCHEMBL11063280 0.83 DRD2 (0.53) DRD2DRD3DRD4HTR1AHTR2A
SCHEMBL11071420 0.82 DRD2 (0.47) DRD2DRD3DRD4HTR1AHTR2A
SCHEMBL11071326 0.82 DRD2 (0.47) DRD2DRD3DRD4MAOAMAOB

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-4482560-A Carbostyril derivatives, and antihistaminic agents containing the same OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1984-11-13 US disclosed