SCHEMBL10635985

SCHEMBL10635985

CCOC(=O)CC1CCc2ccc(O)cc2O1

nearest known ligand 0.60

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 6/20 0.56
DRD4 P21917 6/20 0.56
DRD3 P35462 6/20 0.56
DRD1 P21728 3/20 0.56
DRD5 P21918 3/20 0.56

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
SCHEMBL6954907 0.90 CYP4F2 (0.48) DRD2DRD4DRD3DRD1DRD5
SCHEMBL10664848 0.88 DRD2 (0.51) DRD2DRD4DRD3DRD1DRD5
SCHEMBL10636286 0.85 DRD2 (0.51) DRD2DRD4DRD3DRD1DRD5
SCHEMBL6355159 0.83 CA2 (0.50)
SCHEMBL10635876 0.81 HTR6 (0.61) DRD2DRD4DRD3DRD1DRD5
SCHEMBL17965962 0.80 DRD2 (0.58) DRD2DRD4DRD3DRD1DRD5
SCHEMBL9838425 0.80 CYP4F2 (0.62) DRD2DRD4DRD3DRD1DRD5
SCHEMBL9837746 0.80 CYP4F2 (0.62) DRD2DRD4DRD3DRD1DRD5
SCHEMBL1019684 0.80 CYP4F2 (0.62) DRD2DRD4DRD3DRD1DRD5
SCHEMBL29586758 0.80 CYP4F2 (0.62) DRD2DRD4DRD3DRD1DRD5

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4788214-A ANTIALLERGENS HOFFMAN-LA ROCHE INC. (US) 1988-11-29 US disclosed
US-4785017-A ANTIALLERGENS HOFFMANN-LA ROCHE INC. (US) 1988-11-15 US disclosed