SCHEMBL1287101

SCHEMBL1287101

COC(=O)N1CC[C@@H](c2cc(=O)[nH]o2)C[C@H]1CN1CCOCC1

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PLG P00747 11/20 0.44
GAA P10253 1/20 0.37
GABRA1 P14867 1/20 0.36
GABRG2 P18507 1/20 0.36
GABRB3 P28472 1/20 0.36
THRB P10828 3/20 0.36
LMNA P02545 1/20 0.36
OPRK1 P41145 1/20 0.35
MEN1 O00255 1/20 0.33
PKM P14618 1/20 0.33
KMT2A Q03164 1/20 0.33
MAPK1 P28482 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
BRD4 O60885 1/20 0.33
CREBBP Q92793 1/20 0.33

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
SCHEMBL1287047 1.00 PLG (0.44) PLGGAAGABRA1GABRG2GABRB3
SCHEMBL1287049 1.00 PLG (0.44) PLGGAAGABRA1GABRG2GABRB3
SCHEMBL1287012 0.88 PLG (0.44) PLGGABRA1GABRG2GABRB3THRB
SCHEMBL1287051 0.85 PLG (0.44) PLGGABRA1GABRG2GABRB3THRB
SCHEMBL1287048 0.85 PLG (0.44) PLGGABRA1GABRG2GABRB3THRB
SCHEMBL1287094 0.85 PLG (0.44) PLGGABRA1GABRG2GABRB3THRB
SCHEMBL1287052 0.84 PLG (0.40) PLGGABRA1GABRG2GABRB3
SCHEMBL1287098 0.84 PLG (0.40) PLGGABRA1GABRG2GABRB3
SCHEMBL1287036 0.84 PLG (0.40) PLGGABRA1GABRG2GABRB3
SCHEMBL581377 0.82 PLG (0.52) PLGGABRA1GABRG2GABRB3THRB

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2012047156-A1 ISOXAZOL-3(2H)-ONE ANALOGS AS PLASMINOGEN INHIBITORS AND THEIR USE IN THE TREATMENT OF FIBRINOLYSIS RELATED DISEASES ASTRAZENECA AB (SE) 2012-04-12 WO disclosed