SCHEMBL11071121

SCHEMBL11071121

O=C1CCc2cccc(OCCCN3CCC(O)(c4ccc(F)cc4)CC3)c2N1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 13/20 0.53
DRD3 P35462 6/20 0.53
HTR1A P08908 5/20 0.53
SLC6A2 P23975 5/20 0.53
HTR2A P28223 5/20 0.53
SLC6A4 P31645 5/20 0.53
HRH1 P35367 5/20 0.53
HTR2B P41595 5/20 0.53
DRD1 P21728 4/20 0.53
DRD5 P21918 4/20 0.53
HTR7 P34969 4/20 0.53
DRD4 P21917 2/20 0.48
CCR1 P32246 1/20 0.46
SLC6A3 Q01959 3/20 0.45
CYP1A2 P05177 2/20 0.45
CYP3A4 P08684 2/20 0.45
ADRA2A P08913 2/20 0.45
CYP2D6 P10635 2/20 0.45
CHRM1 P11229 2/20 0.45
ADRA2B P18089 2/20 0.45

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
SCHEMBL11066899 0.92 HTR7 (0.50) DRD2DRD3HTR1ASLC6A2HTR2A
SCHEMBL11068676 0.92 KCNH2 (0.53) DRD2DRD3HTR1ASLC6A2HTR2A
SCHEMBL11062876 0.91 DRD2 (0.47) DRD2DRD3HTR1ASLC6A2HTR2A
SCHEMBL11073945 0.91 DRD2 (0.58) DRD2DRD3HTR1ASLC6A2HTR2A
SCHEMBL11064025 0.87 DRD2 (0.44) DRD2DRD3HTR1AHTR2ADRD4
SCHEMBL11073453 0.86 DRD2 (0.44) DRD2DRD3HTR1AHTR2AHTR7
SCHEMBL11065050 0.86 DRD2 (0.51) DRD2DRD3HTR1ASLC6A2HTR2A
SCHEMBL11064850 0.85 DRD2 (0.48) DRD2DRD3HTR1ASLC6A2HTR2A
SCHEMBL11063280 0.84 DRD2 (0.53) DRD2DRD3HTR1ASLC6A2HTR2A
SCHEMBL11064042 0.83 DRD2 (0.43) DRD2DRD3HTR1AHTR2ADRD4

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