SCHEMBL2311230

SCHEMBL2311230

NCCCC(OP(=O)(O)O)[C@H](N)C(=O)O

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GSR P00390 1/20 0.40
CPB2 Q96IY4 2/20 0.38
PTPN1 P18031 1/20 0.36
RNPEP Q9H4A4 1/20 0.35
SMPD1 P17405 3/20 0.33
LMNA P02545 1/20 0.32
CYP3A4 P08684 1/20 0.32
NFKB1 P19838 1/20 0.32
BLM P54132 1/20 0.32
PMP22 Q01453 1/20 0.32

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
Water SCHEMBL9195067 0.88 GABRR1 (0.35) GSR
SCHEMBL28881933 0.78 USP2 (0.39) PTPN1
SCHEMBL850646 0.78 USP2 (0.39) PTPN1
SCHEMBL850647 0.78 USP2 (0.39) PTPN1
SCHEMBL2541174 0.74 LMNA (0.39) GSRSMPD1LMNACYP3A4NFKB1
SCHEMBL28015797 0.73 GSR (0.44) GSRCPB2RNPEPLMNACYP3A4
SCHEMBL28603061 0.72 LMNA (0.38) GSRSMPD1LMNACYP3A4NFKB1
SCHEMBL8015462 0.70 GSR (0.48) GSRCPB2RNPEPLMNABLM
SCHEMBL2420751 0.70 GSR (0.48) GSRCPB2RNPEPLMNABLM
Ornithine Aketoglutarate SCHEMBL21777564 0.70 GSR (0.72) GSR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-4738554-B2 2011-08-03 JP claimed
EP-1021175-A4 COMPOUNDS AND METHODS FOR THERAPEUTIC INTERVENTION IN PREVENTING DIABETIC COMPLICATIONS FOX CHASE CANCER CT (US) 2002-08-28 EP claimed
JP-2001512424-A 2001-08-21 JP claimed
EP-1021175-A1 COMPOUNDS AND METHODS FOR THERAPEUTIC INTERVENTION IN PREVENTING DIABETIC COMPLICATIONS FOX CHASE CANCER CENTER (US) 2000-07-26 EP claimed
WO-1998033492-A1 COMPOUNDS AND METHODS FOR THERAPEUTIC INTERVENTION IN PREVENTING DIABETIC COMPLICATIONS FOX CHASE CANCER CENTER (US) 1998-08-06 WO claimed
CN-117761174-A Method for detecting metabolites in konjak and rhizosphere soil at different Pcc infection stages 昆明学院 2024-03-26 CN disclosed
EP-1576093-A4 3-DEOXYGLUCOSONE AND SKIN DYNAMIS THERAPEUTICS INC (US) 2009-07-08 EP disclosed
WO-2007117394-A2 COMPOSITIONS AND METHODS RELATED TO FRUCTOSAMINE-3-KINASE INHIBITORS DYNAMIS THERAPEUTICS, INC. (US) 2007-10-18 WO disclosed
EP-1576093-A2 3-DEOXYGLUCOSONE AND SKIN Dynamis Therapeutics, Inc. (US) 2005-09-21 EP disclosed
WO-2003089601-A2 3-DEOXYGLUCOSONE AND SKIN DYNAMIS THERAPEUTICS, INC. (US) 2003-10-30 WO disclosed