SCHEMBL5318018

SCHEMBL5318018

OC[C@H]1OC(n2cnc3c(Cl)nncc32)C(O)[C@@H]1O

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.59
TP53 P04637 1/20 0.59
HPGD P15428 1/20 0.52
DPP4 P27487 1/20 0.51
MEN1 O00255 1/20 0.51
SLC28A1 O00337 1/20 0.51
MAP3K7 O43318 1/20 0.51
SLC28A2 O43868 1/20 0.51
GAPDH P04406 1/20 0.51
ADORA3 P0DMS8 1/20 0.51
MAPK1 P28482 1/20 0.51
ADORA2A P29274 1/20 0.51
ADORA2B P29275 1/20 0.51
ADORA1 P30542 1/20 0.51
STAT6 P42226 1/20 0.51
PI4KA P42356 1/20 0.51
KMT2A Q03164 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
PI4K2B Q8TCG2 1/20 0.51
DOT1L Q8TEK3 1/20 0.51

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
SCHEMBL1800006 1.00 LMNA (0.59) LMNATP53HPGDDPP4MEN1
SCHEMBL2911993 0.85 ADORA2A (0.60) LMNATP53DPP4MEN1SLC28A1
SCHEMBL2911996 0.85 ADORA2A (0.60) LMNATP53DPP4MEN1SLC28A1
SCHEMBL13787625 0.85 ADORA2A (0.60) LMNATP53DPP4MEN1SLC28A1
SCHEMBL2912997 0.82 ADORA2A (0.53) LMNATP53DPP4MEN1SLC28A1
SCHEMBL20419308 0.81 LMNA (0.60) LMNATP53HPGDDPP4MEN1
SCHEMBL11132955 0.81 LMNA (0.60) LMNATP53HPGDDPP4MEN1
SCHEMBL12226010 0.80 PI4KA (0.56) LMNATP53ADORA3ADORA2AADORA2B
SCHEMBL12200113 0.80 PI4KA (0.56) LMNATP53ADORA3ADORA2AADORA2B
SCHEMBL1795540 0.80 PI4KA (0.56) LMNATP53ADORA3ADORA2AADORA2B

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-1848718-A1 INHIBITORS OF E1 ACTIVATING ENZYMES MILLENNIUM PHARMACEUTICALS, INC. (US) 2007-10-31 EP disclosed
WO-2006084281-A1 INHIBITORS OF E1 ACTIVATING ENZYMES MILLENNIUM PHARMACEUTICALS, INC. (US) 2006-08-10 WO disclosed