SCHEMBL10279580

SCHEMBL10279580

CNc1cccc(C(=O)Nc2ccc(-c3nc4ncccc4s3)cc2)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.53
TP53 P04637 3/20 0.53
MMP2 P08253 1/20 0.52
MMP9 P14780 1/20 0.52
MMP8 P22894 1/20 0.52
MMP13 P45452 1/20 0.52
NR1H4 Q96RI1 1/20 0.45
KDM4E B2RXH2 2/20 0.44
NPC1 O15118 2/20 0.44
RAB9A P51151 2/20 0.44
APP P05067 2/20 0.44
PRMT5 O14744 1/20 0.43
PDGFRB P09619 1/20 0.43
KDR P35968 1/20 0.43
POLB P06746 2/20 0.43
TRPV1 Q8NER1 1/20 0.43
RXFP1 Q9HBX9 1/20 0.43
CYP3A4 P08684 2/20 0.43
MEN1 O00255 1/20 0.42
GLA P06280 1/20 0.42

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
SCHEMBL14484154 0.92 MAPT (0.55) MAPTKDM4ENPC1RAB9APOLB
SCHEMBL2740038 0.86 MAPT (0.73) MAPTTP53MMP2MMP9MMP8
SCHEMBL2740039 0.82 MAPT (0.55) MAPTKDM4ENPC1RAB9APOLB
SCHEMBL13189380 0.80 APP (0.61) MAPTAPPKDRMEN1GLA
SCHEMBL2195081 0.79 MAPT (0.65) MAPTTP53MMP2MMP9MMP8
SCHEMBL2739960 0.79 SIRT1 (0.65) MAPTTP53KDM4ENPC1RAB9A
SCHEMBL17446851 0.79 MEN1 (0.58) MAPTTP53NPC1RAB9APOLB
SCHEMBL14484061 0.77 TOP1 (0.53) MAPTKDM4ENPC1RAB9APDGFRB
SCHEMBL2740042 0.76 SIRT1 (0.65) MAPTTP53KDM4ENPC1RAB9A
SCHEMBL2740037 0.74 TP53 (0.58) MAPTTP53KDM4ENPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2468752-A1 Thiazolopyridine derivatives as sirtuin-modulators Sirtris Pharmaceuticals, Inc. (US) 2012-06-27 EP disclosed
EP-2388263-A1 Imidazo[2,1-b]thiazole derivatives as sirtuin modulators Sirtris Pharmaceuticals, Inc. (US) 2011-11-23 EP disclosed
WO-2007064902-A2 MASS SPECTROMETRY ASSAYS FOR ACETYLTRANSFERASE/DEACETYLASE ACTIVITY SIRTRIS PHARMACEUTICALS, INC. (US) 2007-06-07 WO disclosed
WO-2007019346-A1 BENZOTHIAZOLES AND THIAZOLOPYRIDINES AS SIRTUIN MODULATORS SIRTRIS PHARMACEUTICALS, INC. (US) 2007-02-15 WO disclosed
WO-2007019344-A1 IMIDAZO [2,1-B] THIAYOLE DERIVATIVES AS SIRTUIN MODULATING COMPOUNDS SIRTRIS PHARMACEUTICALS, INC. (US) 2007-02-15 WO disclosed
WO-2007019417-A1 OXAZOLOPYRIDINE DERIVATIVES AS SIRTUIN MODULATORS SIRTRIS PHARMACEUTICALS, INC. (US) 2007-02-15 WO disclosed
WO-2007019416-A1 BENZIMIDAZOLE DERIVATIVES AS SIRTUIN MODULATORS SIRTRIS PHARMACEUTICALS, INC. (US) 2007-02-15 WO disclosed
WO-2007019345-A1 IMIDAZOPYRIDINE DERIVATIVES AS SIRTUIN MODULATING AGENTS SIRTRIS PHARMACEUTICALS, INC. (US) 2007-02-15 WO disclosed