SCHEMBL5585804

SCHEMBL5585804

CCCCN1CCC1(OC)OC

nearest known ligand 0.35

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 4/20 0.35
DRD3 P35462 4/20 0.35
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
SIGMAR1 Q99720 3/20 0.32
S1PR1 P21453 2/20 0.31
S1PR3 Q99500 2/20 0.31
S1PR5 Q9H228 2/20 0.31
EBP Q15125 1/20 0.30
KCNH2 Q12809 1/20 0.30
S1PR4 O95977 1/20 0.30

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
SCHEMBL1134144 0.88 DRD2 (0.33) DRD2DRD3MEN1KMT2ASIGMAR1
SCHEMBL5586065 0.86 SIGMAR1 (0.33) DRD2DRD3SIGMAR1EBP
SCHEMBL5137676 0.82 ALOX5 (0.33) MEN1KMT2ASIGMAR1S1PR1S1PR3
SCHEMBL5585764 0.80 OPRM1 (0.32) DRD2DRD3MEN1KMT2ASIGMAR1
SCHEMBL5585885 0.78 DRD2 (0.31) DRD2DRD3S1PR1S1PR3S1PR5
SCHEMBL5585752 0.77 SIGMAR1 (0.31) DRD2DRD3SIGMAR1
SCHEMBL5586038 0.75 BDKRB2 (0.31) DRD2
SCHEMBL5585662 0.71 SIGMAR1 (0.31) DRD2DRD3MEN1KMT2ASIGMAR1
SCHEMBL5586029 0.71 DRD2 (0.30) DRD2DRD3
SCHEMBL5585888 0.69 SIGMAR1 (0.30) SIGMAR1

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
EP-1836238-A1 FUNCTIONALIZED POLYMERS AND IMPROVED TIRES THEREFROM Bridgestone Corporation (JP) 2007-09-26 EP disclosed
WO-2006076629-A1 FUNCTIONALIZED POLYMERS AND IMPROVED TIRES THEREFROM BRIDGESTONE CORPORATION (JP) 2006-07-20 WO disclosed