SCHEMBL11068038

SCHEMBL11068038

O=C1CCc2ccc(OCCCN3CCC(O)(c4ccccc4Cl)CC3)cc2N1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 7/20 0.68
MAOA P21397 13/20 0.67
MAOB P27338 12/20 0.67
DRD4 P21917 2/20 0.67
DRD3 P35462 2/20 0.67
HTR3E A5X5Y0 1/20 0.62
MEN1 O00255 1/20 0.62
MLNR O43193 1/20 0.62
HTR3B O95264 1/20 0.62
ABCB11 O95342 1/20 0.62
ESR1 P03372 1/20 0.62
PGR P06401 1/20 0.62
ADRB2 P07550 1/20 0.62
CHRM2 P08172 1/20 0.62
ABCB1 P08183 1/20 0.62
ADRB1 P08588 1/20 0.62
HTR1A P08908 1/20 0.62
ADRA2A P08913 1/20 0.62
ADORA3 P0DMS8 1/20 0.62
GAA P10253 1/20 0.62

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
SCHEMBL11066469 0.94 DRD2 (0.61) DRD2MAOAMAOBDRD4DRD3
SCHEMBL11068613 0.91 DRD2 (0.69) DRD2MAOAMAOBDRD4DRD3
SCHEMBL11061128 0.89 MAOA (0.65) DRD2MAOAMAOBDRD4DRD3
SCHEMBL11065814 0.89 DRD2 (0.67) DRD2MAOAMAOBDRD4DRD3
SCHEMBL11062925 0.87 DRD2 (0.75) DRD2MAOAMAOBDRD4DRD3
Hydrochloric Acid SCHEMBL11062772 0.86 DRD2 (0.71) DRD2MAOAMAOBDRD4DRD3
SCHEMBL11063747 0.86 DRD2 (0.88) DRD2MAOAMAOBDRD4DRD3
SCHEMBL11071821 0.85 DRD2 (0.72) DRD2MAOAMAOBDRD4DRD3
SCHEMBL11063037 0.84 DRD2 (0.79) DRD2MAOAMAOBDRD4DRD3
SCHEMBL11069040 0.84 DRD2 (0.61) DRD2MAOAMAOBDRD4DRD3

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