SCHEMBL7876936

SCHEMBL7876936

O=C(O)CN(CP(=O)(O)O)C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 3/20 0.46
LMNA P02545 2/20 0.46
TSHR P16473 2/20 0.46
BLM P54132 2/20 0.46
MEN1 O00255 1/20 0.46
HPGD P15428 1/20 0.46
KMT2A Q03164 1/20 0.46
EYA2 O00167 1/20 0.35
APP P05067 1/20 0.35
ACE P12821 1/20 0.35
KDM4E B2RXH2 1/20 0.33
CHRM2 P08172 1/20 0.33
ADRA2A P08913 1/20 0.33
ALOX15 P16050 1/20 0.33
DRD1 P21728 1/20 0.33
SLC6A2 P23975 1/20 0.33
SLC6A4 P31645 1/20 0.33
CYP2C19 P33261 1/20 0.33
ADRA1A P35348 1/20 0.33
DRD3 P35462 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
SCHEMBL6794530 0.86 TDP1 (0.40) TDP1LMNATSHRBLMMEN1
SCHEMBL8156617 0.83 TDP1 (0.42) TDP1LMNATSHRBLMMEN1
SCHEMBL249304 0.82 TDP1 (0.37) TDP1LMNATSHRBLMMEN1
SCHEMBL11324627 0.80 PHF8 (0.39) TDP1LMNATSHRBLMMEN1
SCHEMBL7763569 0.79 ENO1 (0.35) TDP1LMNATSHRBLMMEN1
SCHEMBL2988195 0.79 TDP1 (0.34) TDP1LMNATSHRBLMMEN1
SCHEMBL8967699 0.77 MEN1 (0.33) TDP1LMNATSHRBLMMEN1
SCHEMBL7875291 0.77 MVD (0.33) TDP1LMNATSHRBLMMEN1
SCHEMBL4750608 0.77 MEN1 (0.33) TDP1LMNATSHRBLMMEN1
SCHEMBL562965 0.76 TDP1 (0.47) TDP1LMNATSHRBLMMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0112580-B1 PROCESS FOR PREPARING PHOSPHONOMETHYLATED AMINO ACIDS STAUFFER CHEMICAL COMPANY (US) 1986-05-21 EP claimed
WO-2001056358-A2 ENHANCED PROPERTIED PESTICIDES ROHM AND HAAS COMPANY (US) 2001-08-09 WO disclosed
EP-0112580-B1 PROCESS FOR PREPARING PHOSPHONOMETHYLATED AMINO ACIDS STAUFFER CHEMICAL COMPANY (US) 1986-05-21 EP disclosed
US-4312662-A N-Substituted carboxy-N-phosphonomethylglycines and the salts thereof as herbicides MONSANTO COMPANY (US) 1982-01-26 US disclosed
US-4312662-A N-Substituted carboxy-N-phosphonomethylglycines and the salts thereof as herbicides MONSANTO COMPANY (US) 1982-01-26 US disclosed
US-4312662-A N-Substituted carboxy-N-phosphonomethylglycines and the salts thereof as herbicides MONSANTO COMPANY (US) 1982-01-26 US disclosed