SCHEMBL1305528

SCHEMBL1305528

CC(COc1ccc(N(C(N)=O)c2cc(Cl)c(Cl)c(Cl)c2)cc1)C(=O)O

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.36
POLB P06746 2/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
ALDH1A1 P00352 2/20 0.36
RAB9A P51151 1/20 0.36
CYP1A2 P05177 1/20 0.35
FFAR1 O14842 2/20 0.35
PPARA Q07869 2/20 0.35
ACACB O00763 1/20 0.35
PPARD Q03181 1/20 0.35
PPARG P37231 1/20 0.34
ALOX5 P09917 1/20 0.34
PKM P14618 1/20 0.33
SRD5A2 P31213 1/20 0.33
HTT P42858 2/20 0.33
NR1H4 Q96RI1 1/20 0.33
LMNA P02545 1/20 0.33
HSP90AA1 P07900 1/20 0.33
NPSR1 Q6W5P4 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
SCHEMBL1304563 0.91 MAOA (0.39) SMN1; SMN2POLBMEN1KMT2AALDH1A1
SCHEMBL1306105 0.89 CYP1A2 (0.39) SMN1; SMN2POLBMEN1KMT2AALDH1A1
SCHEMBL1304996 0.87 PTGIR (0.38) SMN1; SMN2POLBMEN1KMT2AALDH1A1
SCHEMBL1304682 0.85 ALOX5 (0.43) SMN1; SMN2POLBFFAR1PPARAPPARG
SCHEMBL1305269 0.85 CYP1A2 (0.37) SMN1; SMN2POLBMEN1KMT2AALDH1A1
SCHEMBL1304974 0.84 MAOB (0.38) SMN1; SMN2POLBFFAR1PPARAPPARD
SCHEMBL1304907 0.84 MAOB (0.39) CYP1A2PPARAPPARGALOX5MAOA
SCHEMBL1305107 0.84 L3MBTL1 (0.41) SMN1; SMN2POLBALDH1A1CYP1A2ALOX5
SCHEMBL1304251 0.84 LDHA (0.41) SMN1; SMN2POLBKMT2AALDH1A1RAB9A
SCHEMBL1305429 0.84 HDAC1 (0.46) SMN1; SMN2POLBMEN1KMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8048896-B2 Inhibit nonenzymatic formation of advanced glycation end-products (AGE) using e.g. aminoguanidine, OPB-9195 [(+/-)-2-isopropylidenehydrazono-4-oxo-thiazolidin-5-yla cetanilide], pyridoxamine, antioxidants, alagebrium, antihypertensives, angiotensin-converting enzyme inhibitors Cell Viable Corporation (US) 2011-11-01 US claimed
EP-1165064-B1 NOVEL INHIBITORS OF FORMATION OF ADVANCED GLYCATION ENDPRODUCTS (AGE'S) HOPE CITY (US) 2004-02-25 EP claimed
US-6337350-B1 CROSSLINKING INHIBITION OF PROTEINS CITY OF HOPE 2002-01-08 US claimed
EP-1165064-A2 NOVEL INHIBITORS OF FORMATION OF ADVANCED GLYCATION ENDPRODUCTS (AGE'S) City of Hope (US) 2002-01-02 EP claimed
WO-2000059875-A2 NOVEL INHIBITORS OF FORMATION OF ADVANCED GLYCATION ENDPRODUCTS (AGE'S) CITY OF HOPE (US) 2000-10-12 WO claimed
US-8053449-B2 Method for inhibiting AGE complex formation Cell Viable Corporation (US) 2011-11-08 US disclosed
US-8048896-B2 Inhibit nonenzymatic formation of advanced glycation end-products (AGE) using e.g. aminoguanidine, OPB-9195 [(+/-)-2-isopropylidenehydrazono-4-oxo-thiazolidin-5-yla cetanilide], pyridoxamine, antioxidants, alagebrium, antihypertensives, angiotensin-converting enzyme inhibitors Cell Viable Corporation (US) 2011-11-01 US disclosed
US-20080076804-A1 METHODS FOR INHIBITING AND BREAKING AGE COMPLEX FORMATION Cell Viable Corporation 2008-03-27 US disclosed
US-20070099966-A1 Device and Method for Inhibiting AGE Complex Formation Cell Viable Corporation 2007-05-03 US disclosed
WO-2007044309-A2 DEVICE AND METHOD FOR INHIBITING AGE COMPLEX FORMATION VASIX CORPORATION (US) 2007-04-19 WO disclosed
EP-1165064-B1 NOVEL INHIBITORS OF FORMATION OF ADVANCED GLYCATION ENDPRODUCTS (AGE'S) HOPE CITY (US) 2004-02-25 EP disclosed
US-6337350-B1 CROSSLINKING INHIBITION OF PROTEINS CITY OF HOPE 2002-01-08 US disclosed
EP-1165064-A2 NOVEL INHIBITORS OF FORMATION OF ADVANCED GLYCATION ENDPRODUCTS (AGE'S) City of Hope (US) 2002-01-02 EP disclosed
WO-2000059875-A2 NOVEL INHIBITORS OF FORMATION OF ADVANCED GLYCATION ENDPRODUCTS (AGE'S) CITY OF HOPE (US) 2000-10-12 WO disclosed