SCHEMBL4016928

SCHEMBL4016928

COC(=O)CCc1cc(C(=O)c2c(Cl)c(Cl)c(Cl)c(Cl)c2[14C](=O)O)c(O)c(F)c1O

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.32
MAPK1 P28482 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
SCHEMBL4358008 0.85 ALDH1A1 (0.34) ALDH1A1MAPK1
SCHEMBL4013710 0.77 ALDH1A1 (0.38) ALDH1A1MAPK1
SCHEMBL4358116 0.75 L3MBTL1 (0.33) ALDH1A1MAPK1
SCHEMBL4361731 0.74 L3MBTL1 (0.32) ALDH1A1MAPK1
SCHEMBL4011884 0.74 ALDH1A1 (0.36) ALDH1A1MAPK1
SCHEMBL4018520 0.71 KMT2A (0.41) ALDH1A1MAPK1
SCHEMBL4358865 0.71 ALDH1A1 (0.36) ALDH1A1MAPK1
SCHEMBL4012367 0.69 ACLY (0.35) ALDH1A1MAPK1
SCHEMBL4363671 0.68 DPP4 (0.37) ALDH1A1MAPK1
SCHEMBL14458606 0.68

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-1991705-A4 COMPOUNDS AND METHODS FOR FLUORESCENT LABELING EPOCH BIOSCIENCES INC (US) 2009-07-01 EP disclosed
EP-1991705-A2 COMPOUNDS AND METHODS FOR FLUORESCENT LABELING Epoch Biosciences, Inc. (US) 2008-11-19 EP disclosed
EP-1466176-A4 COMPOUNDS AND METHODS FOR FLUORESCENT LABELING EPOCH BIOSCIENCES INC (US) 2008-10-01 EP disclosed
WO-2007098336-A2 COMPOUNDS AND METHODS FOR FLUORESCENT LABELING EPOCH BIOSCIENCES, INC. (US) 2007-08-30 WO disclosed
EP-1466176-A2 COMPOUNDS AND METHODS FOR FLUORESCENT LABELING Epoch Biosciences, Inc. (US) 2004-10-13 EP disclosed
WO-2003023357-A2 COMPOUNDS AND METHODS FOR FLUORESCENT LABELING EPOCH BIOSCIENCES, INC. (US) 2003-03-20 WO disclosed