SCHEMBL6257233

SCHEMBL6257233

CC(COP(=O)(O)O)S(=O)(=O)CC1CCCC1

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
METAP1 P53582 1/20 0.35
PGK1 P00558 1/20 0.33
PGK2 P07205 1/20 0.33
LPAR5 Q9H1C0 1/20 0.32
FBP1 P09467 1/20 0.32
LPAR1 Q92633 2/20 0.31
LPAR3 Q9UBY5 2/20 0.31
PGD P52209 3/20 0.31
MPI P34949 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
SCHEMBL6260891 0.82 LPAR5 (0.33) METAP1PGK1PGK2LPAR5LPAR1
SCHEMBL6261707 0.81 LPAR5 (0.33) PGK1PGK2LPAR5LPAR1LPAR3
SCHEMBL6262026 0.76
SCHEMBL6257454 0.76 MMP1 (0.33) PGD
SCHEMBL24767641 0.71 SHBG (0.35) METAP1
SCHEMBL6260667 0.70 METAP1 (0.33) METAP1
SCHEMBL18624724 0.69 ADH1B (0.30)
SCHEMBL6258650 0.69 CA12 (0.32) METAP1FBP1LPAR1LPAR3
SCHEMBL6257820 0.69 CA12 (0.34) LPAR1LPAR3
SCHEMBL6259716 0.68 REN (0.33) METAP1

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