SCHEMBL6263273

SCHEMBL6263273

Cc1nc(CC(C)OP(=O)(O)O)sc1C

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SLC6A3 Q01959 1/20 0.35
FBP1 P09467 7/20 0.33
OPRM1 P35372 1/20 0.33
SLC5A7 Q9GZV3 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
SCHEMBL6258463 0.85
SCHEMBL6257799 0.71 TDP1 (0.34) SLC6A3FBP1
SCHEMBL30036876 0.69 SLC6A3 (0.36) SLC6A3OPRM1
SCHEMBL6263275 0.66 APLNR (0.34) FBP1
SCHEMBL5898085 0.63
SCHEMBL3257324 0.63
SCHEMBL2819116 0.62 LAP3 (0.53) SLC6A3
SCHEMBL27970992 0.61 SLC6A3 (0.41) SLC6A3OPRM1
SCHEMBL26334851 0.61 VHL (0.42) SLC6A3OPRM1
SCHEMBL115387 0.61

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
WO-2005080406-A2 COMPOUNDS FOR THE INHIBITION OF UNDESIRED CELL PROLIFERATION AND USE THEREOF JERINI AG (DE) 2005-09-01 WO claimed
WO-2005080406-A2 COMPOUNDS FOR THE INHIBITION OF UNDESIRED CELL PROLIFERATION AND USE THEREOF JERINI AG (DE) 2005-09-01 WO disclosed