SCHEMBL7907992

SCHEMBL7907992

Nc1cccc(Nc2nc3ccccc3o2)c1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 8/20 0.69
RAB9A P51151 8/20 0.69
SMN1; SMN2 Q16637 6/20 0.69
NPSR1 Q6W5P4 2/20 0.69
GAA P10253 2/20 0.69
PKM P14618 2/20 0.69
ALDH1A1 P00352 1/20 0.69
MAPT P10636 4/20 0.57
MEN1 O00255 4/20 0.57
KMT2A Q03164 4/20 0.57
KDM4E B2RXH2 3/20 0.50
AHR P35869 1/20 0.50
LMNA P02545 1/20 0.50
GFER P55789 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
IL6 P05231 1/20 0.49
STAT3 P40763 1/20 0.49
POLB P06746 1/20 0.48
CASP6 P55212 1/20 0.48
PIM1 P11309 1/20 0.46

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
SCHEMBL29236673 0.84 NPC1 (0.58) NPC1RAB9ASMN1; SMN2NPSR1GAA
SCHEMBL3949035 0.83 NPC1 (0.71) NPC1RAB9ASMN1; SMN2NPSR1GAA
SCHEMBL25292085 0.83 SIRT7 (0.53) NPC1RAB9ASMN1; SMN2NPSR1GAA
SCHEMBL25788974 0.83 NPC1 (0.58) NPC1RAB9ASMN1; SMN2NPSR1GAA
SCHEMBL25247545 0.83 IL6 (0.51) NPC1RAB9ASMN1; SMN2NPSR1GAA
SCHEMBL25242316 0.83 NPC1 (0.48) NPC1RAB9ASMN1; SMN2NPSR1GAA
SCHEMBL29972698 0.83 NPC1 (0.75) NPC1RAB9ASMN1; SMN2NPSR1GAA
SCHEMBL1699100 0.83 NPC1 (0.75) NPC1RAB9ASMN1; SMN2NPSR1GAA
SCHEMBL2658434 0.82 NPC1 (1.00) NPC1RAB9ASMN1; SMN2NPSR1GAA
SCHEMBL18235580 0.82 NPC1 (0.69) NPC1RAB9ASMN1; SMN2NPSR1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6222044-B1 REACTING AN AROMATIC ALDEHYDE WITH HYDROXYLAMINE TO FORM AN AROMATIC ALDEHYDE OXIME, HALOGENATING OXIME TO FORM AROMATIC HYDROXAMOYL HALIDE, AND REACTING WITH AROMATIC AMINE COMPOUNDS TO FORM BENZOXAZOLE, BENZOTHIAXOLE, BENZIMIDAZOLES THE DOW CHEMICAL COMPANY 2001-04-24 US disclosed
EP-0820447-B1 PROCESS FOR MAKING 2-ARYL BENZ(OX, THI, IMID)AZOLES AND 2-AMINOARYL AMINOBENZ(OX, THI, IMID)AZOLES DOW CHEMICAL CO (US) 2000-08-23 EP disclosed
EP-0820447-A1 PROCESS FOR MAKING 2-ARYL BENZ(OX, THI, IMID)AZOLES AND 2-AMINOARYL AMINOBENZ(OX, THI, IMID)AZOLES THE DOW CHEMICAL COMPANY (US) 1998-01-28 EP disclosed
US-5567843-A Process for making 2-aryl benz (ox, thi, imid)azoles and 2-aminoaryl aminobenz(ox, thi, imid)azoles THE DOW CHEMICAL COMPANY (US) 1996-10-22 US disclosed
WO-1996029319-A1 PROCESS FOR MAKING 2-ARYL BENZ(OX, THI, IMID)AZOLES AND 2-AMINOARYL AMINOBENZ(OX, THI, IMID)AZOLES THE DOW CHEMICAL COMPANY (US) 1996-09-26 WO disclosed