SCHEMBL11064186

SCHEMBL11064186

CCC(=O)C1(c2ccccc2)CCN(CCCOc2cccc3c2CCC(=O)N3)CC1

nearest known ligand 0.51

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
DRD3 P35462 3/20 0.47
HTR7 P34969 1/20 0.44
DRD2 P14416 2/20 0.44
DRD4 P21917 1/20 0.44
KCNA3 P22001 1/20 0.43
OPRM1 P35372 1/20 0.42
OPRD1 P41143 1/20 0.42
OPRK1 P41145 1/20 0.42

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
SCHEMBL11067562 0.92 HTR7 (0.53) DRD3HTR7DRD2DRD4KCNA3
SCHEMBL11070110 0.91 S1PR5 (0.47) DRD3HTR7DRD2DRD4OPRM1
SCHEMBL11071740 0.85 HTR7 (0.50) DRD3HTR7DRD2DRD4OPRK1
SCHEMBL11063139 0.85 DRD3 (0.47) DRD3HTR7DRD2DRD4KCNA3
SCHEMBL11070967 0.83 DRD2 (0.53) DRD3HTR7DRD2DRD4
SCHEMBL11064821 0.81 MAOA (0.65) DRD3DRD2DRD4
SCHEMBL11066559 0.81 DRD2 (0.59) DRD3HTR7DRD2DRD4
SCHEMBL11069074 0.81 HTR7 (0.46) DRD3HTR7DRD2DRD4OPRK1
SCHEMBL10572847 0.79 EPHX2 (0.48) DRD3DRD2DRD4OPRK1
SCHEMBL10570006 0.79 KCNA5 (0.50) DRD3DRD2DRD4

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