SCHEMBL11068613

SCHEMBL11068613

O=C1CCc2ccc(OCCCN3CCC(O)(c4c(Cl)cccc4Cl)CC3)cc2N1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 8/20 0.69
DRD4 P21917 3/20 0.68
DRD3 P35462 3/20 0.68
MAOA P21397 12/20 0.66
MAOB P27338 11/20 0.66
HTR1A P08908 2/20 0.66
DRD1 P21728 2/20 0.66
DRD5 P21918 2/20 0.66
HTR2A P28223 2/20 0.66
HTR2C P28335 2/20 0.66
HTR2B P41595 2/20 0.66
HTR3E A5X5Y0 1/20 0.66
MEN1 O00255 1/20 0.66
MLNR O43193 1/20 0.66
HTR3B O95264 1/20 0.66
ABCB11 O95342 1/20 0.66
ESR1 P03372 1/20 0.66
PGR P06401 1/20 0.66
ADRB2 P07550 1/20 0.66
CHRM2 P08172 1/20 0.66

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
SCHEMBL11069040 0.92 DRD2 (0.61) DRD2DRD4DRD3MAOAMAOB
SCHEMBL11068038 0.91 DRD2 (0.68) DRD2DRD4DRD3MAOAMAOB
SCHEMBL11071821 0.88 DRD2 (0.72) DRD2DRD4DRD3MAOAMAOB
SCHEMBL11063747 0.86 DRD2 (0.88) DRD2DRD4DRD3MAOAMAOB
SCHEMBL11062925 0.86 DRD2 (0.75) DRD2DRD4DRD3MAOAMAOB
SCHEMBL11066469 0.85 DRD2 (0.61) DRD2DRD4DRD3MAOAMAOB
SCHEMBL11066723 0.84 DRD2 (0.65) DRD2DRD4DRD3MAOAMAOB
SCHEMBL11069221 0.84 DRD2 (0.65) DRD2DRD4DRD3MAOAMAOB
SCHEMBL11061128 0.84 MAOA (0.65) DRD2DRD4DRD3MAOAMAOB
SCHEMBL11065814 0.84 DRD2 (0.67) DRD2DRD4DRD3MAOAMAOB

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