SCHEMBL8934471

SCHEMBL8934471

CC(O)CC(NCC(=O)O)C(=O)O

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 4/20 0.39
NAALAD2 Q9Y3Q0 3/20 0.39
ALDH1A1 P00352 3/20 0.39
LAP3 P28838 3/20 0.38
LMNA P02545 2/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
MAPT P10636 2/20 0.36
PTGS2 P35354 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
MME P08473 2/20 0.35
TP53 P04637 1/20 0.35
ACE P12821 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
SCHEMBL24119241 0.85 ALDH1A1 (0.55) FOLH1ALDH1A1LAP3LMNAMEN1
SCHEMBL8585891 0.82 FOLH1 (0.36) FOLH1NAALAD2ALDH1A1LAP3LMNA
SCHEMBL692390 0.78 OR51E2 (0.34) FOLH1NAALAD2ALDH1A1LAP3LMNA
SCHEMBL27808640 0.76 GGT1 (0.51) FOLH1NAALAD2ALDH1A1LAP3LMNA
SCHEMBL3056771 0.76 MME (0.38) FOLH1NAALAD2ALDH1A1LMNAMAPT
SCHEMBL8358625 0.75 FOLH1 (0.43) FOLH1NAALAD2ALDH1A1LMNAMAPT
SCHEMBL7563709 0.74 ALDH1A1 (0.57) FOLH1NAALAD2ALDH1A1LAP3LMNA
SCHEMBL22355918 0.74 FOLH1 (0.52) FOLH1NAALAD2ALDH1A1LAP3LMNA
SCHEMBL7563707 0.74 ALDH1A1 (0.57) FOLH1NAALAD2ALDH1A1LAP3LMNA
Water SCHEMBL27566970 0.74 MME (0.37) FOLH1NAALAD2ALDH1A1LMNAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1996030334-A1 AN AMINO NITRILE INTERMEDIATE FOR THE PREPARATION OF 2-HYDROXYPROPYL IMINODIACETIC ACID THE DOW CHEMICAL COMPANY (US) 1996-10-03 WO claimed
EP-0442251-A1 Hard surface cleaning compositions THE PROCTER & GAMBLE COMPANY (US) 1991-08-21 EP claimed
CN-111819272-B Aqueous cleaning formulations 陶氏环球技术有限责任公司 2021-12-10 CN disclosed
CN-111819272-A Aqueous cleaning formulations 陶氏环球技术有限责任公司 2020-10-23 CN disclosed
WO-1996030334-A1 AN AMINO NITRILE INTERMEDIATE FOR THE PREPARATION OF 2-HYDROXYPROPYL IMINODIACETIC ACID THE DOW CHEMICAL COMPANY (US) 1996-10-03 WO disclosed
WO-1996030334-A1 AN AMINO NITRILE INTERMEDIATE FOR THE PREPARATION OF 2-HYDROXYPROPYL IMINODIACETIC ACID THE DOW CHEMICAL COMPANY (US) 1996-10-03 WO disclosed
US-5488130-A NITRILE INTERMEDIATE FOR REACTION OF WATER THE DOW CHEMICAL COMPANY (US) 1996-01-30 US disclosed
US-5488130-A NITRILE INTERMEDIATE FOR REACTION OF WATER THE DOW CHEMICAL COMPANY (US) 1996-01-30 US disclosed
US-5488130-A NITRILE INTERMEDIATE FOR REACTION OF WATER THE DOW CHEMICAL COMPANY (US) 1996-01-30 US disclosed
EP-0442251-A1 Hard surface cleaning compositions THE PROCTER & GAMBLE COMPANY (US) 1991-08-21 EP disclosed
CN-1047495-A New sequestrant and application thereof PROCETER & GAMBLE CO (US) 1990-12-05 CN disclosed