SCHEMBL11062876

SCHEMBL11062876

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

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 5/20 0.47
DRD3 P35462 5/20 0.47
DRD4 P21917 3/20 0.47
CCR1 P32246 3/20 0.45
HTR7 P34969 2/20 0.43
HTR1A P08908 1/20 0.43
DRD1 P21728 1/20 0.43
DRD5 P21918 1/20 0.43
SLC6A2 P23975 1/20 0.43
HTR2A P28223 1/20 0.43
SLC6A4 P31645 1/20 0.43
HRH1 P35367 1/20 0.43
HTR2B P41595 1/20 0.43
MEN1 O00255 1/20 0.41
ALDH1A1 P00352 1/20 0.41
LMNA P02545 1/20 0.41
KMT2A Q03164 1/20 0.41
KCNH2 Q12809 1/20 0.41
HRH3 Q9Y5N1 3/20 0.40
MAOA P21397 1/20 0.39

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
SCHEMBL11071121 0.91 DRD2 (0.53) DRD2DRD3DRD4CCR1HTR7
SCHEMBL11066899 0.91 HTR7 (0.50) DRD2DRD3DRD4CCR1HTR7
SCHEMBL11073945 0.90 DRD2 (0.58) DRD2DRD3DRD4CCR1HTR7
SCHEMBL11065050 0.85 DRD2 (0.51) DRD2DRD3DRD4CCR1HTR7
SCHEMBL11068676 0.85 KCNH2 (0.53) DRD2DRD3DRD4CCR1HTR7
SCHEMBL11073453 0.85 DRD2 (0.44) DRD2DRD3DRD4CCR1HTR7
SCHEMBL11071326 0.85 DRD2 (0.47) DRD2DRD3DRD4CCR1HTR7
SCHEMBL11064850 0.84 DRD2 (0.48) DRD2DRD3DRD4CCR1HTR7
SCHEMBL11064025 0.82 DRD2 (0.44) DRD2DRD3DRD4HTR1AHTR2A
SCHEMBL11071128 0.82 DRD2 (0.48) DRD2DRD3DRD4CCR1HTR7

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