SCHEMBL8737694

SCHEMBL8737694

CNC(=O)CC(NC(=O)C(C)CC(=O)O)C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MME P08473 5/20 0.44
CA2 P00918 1/20 0.41
CA4 P22748 1/20 0.41
ECE1 P42892 2/20 0.41
BMP1 P13497 3/20 0.40
ACE P12821 1/20 0.40
FOLH1 Q04609 2/20 0.38
NAALAD2 Q9Y3Q0 2/20 0.38
GNPAT O15228 1/20 0.37
ENPEP Q07075 1/20 0.36

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
SCHEMBL10053584 0.87 MME (0.50) MMECA2CA4ECE1ACE
SCHEMBL17277128 0.79 ACE (0.65) MMEBMP1ACEFOLH1
SCHEMBL11412632 0.79 MME (0.58) MMEFOLH1NAALAD2
SCHEMBL17424533 0.78 GNPAT (0.46) MMECA2CA4ECE1ACE
SCHEMBL15828303 0.77 NAALAD2 (0.58) MMEBMP1FOLH1NAALAD2GNPAT
SCHEMBL20886556 0.76 MAPT (0.55) MMECA2CA4ECE1FOLH1
SCHEMBL9068766 0.75 ACE (0.55) MMEACE
SCHEMBL9068730 0.75 ACE (0.55) MMEACE
SCHEMBL14387040 0.75 BMP1 (0.40) MMEBMP1
SCHEMBL4544394 0.75 BMP1 (0.40) MMEBMP1

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
US-8877699-B2 Dishwasher detergent comprising a liquid non-ionic surfactant and at least two solid non-ionic surfactants RECKITT & COLMAN (OVERSEAS) LIMITED (GB) 2014-11-04 US disclosed
US-20140018272-A1 Polyalkylene Glycol Based Heat Transfer Fluids and Monofluid Engine Oils DOW GLOBAL TECHNOLOGIES LLC (US) 2014-01-16 US disclosed
US-20130102507-A1 POLYALKYLENE GLYCOL LUBRICANT COMPOSITION DOW GLOBAL TECHNOLOGIES LLC (US) 2013-04-25 US disclosed
US-8357644-B2 Polyalkylene glycol lubricant composition DOW GLOBAL TECHNOLOGIES LLC (US) 2013-01-22 US disclosed
US-20120125374-A1 Compositions RECKITT BENCKISER N.V. (NL) 2012-05-24 US disclosed
US-20110039741-A1 POLYALKYLENE GLYCOL LUBRICANT COMPOSITION DOW EUROPE GMBH (CH) 2011-02-17 US disclosed