SCHEMBL1305000

SCHEMBL1305000

CC(C)(Oc1ccc(NC(=O)Nc2ccc(F)c(Cl)c2)cc1)C(=O)O

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.68
HTT P42858 4/20 0.68
NPC1 O15118 2/20 0.68
RAB9A P51151 2/20 0.68
SMN1; SMN2 Q16637 2/20 0.68
MEN1 O00255 8/20 0.61
KMT2A Q03164 8/20 0.61
LMNA P02545 4/20 0.61
CASP3 P42574 1/20 0.60
SENP7 Q9BQF6 1/20 0.60
SLC2A1 P11166 1/20 0.58
PPARA Q07869 2/20 0.55
CYP1A2 P05177 1/20 0.55
CYP3A4 P08684 1/20 0.55
CYP2D6 P10635 1/20 0.55
CYP2C19 P33261 1/20 0.55
CA2 P00918 1/20 0.53
IDH1 O75874 2/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
TP53 P04637 1/20 0.49

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
SCHEMBL1304565 0.88 EPHX1 (0.59) MAPTHTTNPC1RAB9ASMN1; SMN2
SCHEMBL1305530 0.86 PPARA (0.55) MAPTHTTNPC1RAB9ASMN1; SMN2
SCHEMBL1306107 0.84 PPARA (0.60) MAPTHTTNPC1RAB9ASMN1; SMN2
SCHEMBL805971 0.84 PPARA (0.61) MAPTNPC1RAB9ASMN1; SMN2MEN1
SCHEMBL16303954 0.84 PPARA (0.61) MAPTNPC1RAB9ASMN1; SMN2MEN1
SCHEMBL1305271 0.84 CA1 (0.58) MAPTHTTNPC1RAB9ASMN1; SMN2
SCHEMBL1304908 0.84 MEN1 (0.62) MAPTHTTNPC1RAB9ASMN1; SMN2
SCHEMBL3372026 0.82 PPARA (0.65) MAPTHTTNPC1RAB9ASMN1; SMN2
SCHEMBL1304976 0.82 EPHX2 (0.53) MAPTHTTNPC1RAB9ASMN1; SMN2
SCHEMBL9303663 0.81 MEN1 (0.57) MAPTHTTNPC1MEN1KMT2A

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 17 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-20160280764-A1 Glycation Cross-link Breakers to Increase Resistance to Enzymatic Degradation NEW YORK SOCIETY FOR THE RUPTURED AND CRIPPLED MAINTAINING THE HOSPITAL FOR SPECIAL SURGERY 2016-09-29 US disclosed
US-9309304-B2 Glycation cross-link breakers to increase resistance to enzymatic degradation CORNELL UNIVERSITY (US) 2016-04-12 US disclosed
US-20130310539-A1 Glycation Cross-link Breakers to Increase Resistance to Enzymatic Degradation NEW YORK SOCIETY FOR THE RELIEF OF THE RUPTURED AND CRIPPLED, MAINTAINING THE HOSPITAL FOR SPECIAL SURGERY 2013-11-21 US disclosed
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