SCHEMBL6258467

SCHEMBL6258467

Cc1sc(C(C)COP(=O)(O)O)nc1C(C)C

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PGK1 P00558 1/20 0.31
PGK2 P07205 1/20 0.31

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
SCHEMBL6263275 0.85 APLNR (0.34) PGK1PGK2
SCHEMBL6258081 0.73 TDP1 (0.32)
SCHEMBL21217155 0.73
SCHEMBL14226108 0.69 TLR8 (0.33)
SCHEMBL6258463 0.68
SCHEMBL21211346 0.65
SCHEMBL22958770 0.62
SCHEMBL759100 0.61
SCHEMBL759324 0.59 POLB (0.46) PGK1PGK2
SCHEMBL1635172 0.59 PGK1 (0.48) PGK1PGK2

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