SCHEMBL11070967

SCHEMBL11070967

O=C1CCc2c(cccc2OCCCCN2CCC(O)(c3ccccc3)CC2)N1

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 9/20 0.53
DRD4 P21917 6/20 0.53
DRD3 P35462 6/20 0.53
HTR7 P34969 1/20 0.52
MEN1 O00255 1/20 0.49
ALDH1A1 P00352 1/20 0.49
LMNA P02545 1/20 0.49
KMT2A Q03164 1/20 0.49
SIGMAR1 Q99720 1/20 0.46
MAOA P21397 3/20 0.44
MAOB P27338 3/20 0.44
TRPM2 O94759 1/20 0.43
PARP1 P09874 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
SCHEMBL11071740 0.97 HTR7 (0.50) DRD2DRD4DRD3HTR7MEN1
SCHEMBL11069074 0.94 HTR7 (0.46) DRD2DRD4DRD3HTR7MEN1
SCHEMBL11063280 0.89 DRD2 (0.53) DRD2DRD4DRD3HTR7MEN1
SCHEMBL11071326 0.88 DRD2 (0.47) DRD2DRD4DRD3HTR7MEN1
SCHEMBL11071420 0.88 DRD2 (0.47) DRD2DRD4DRD3HTR7MEN1
SCHEMBL11065769 0.88 DRD2 (0.58) DRD2DRD4DRD3HTR7MEN1
SCHEMBL11070311 0.88 ADRB2 (0.44) DRD2DRD4DRD3HTR7
SCHEMBL11070769 0.87 DRD2 (0.44) DRD2DRD4DRD3HTR7MEN1
SCHEMBL11064990 0.87 DRD2 (0.51) DRD2DRD4DRD3HTR7MAOA
SCHEMBL11068604 0.87 KCNH2 (0.53) DRD2DRD4DRD3HTR7SIGMAR1

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