SCHEMBL368793

SCHEMBL368793

CNC(=O)c1cnn(Cc2ccc(OC)cc2)c1COC

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NPBWR1 P48145 4/20 0.45
L3MBTL1 Q9Y468 2/20 0.45
ALOX15 P16050 1/20 0.45
JAK1 P23458 7/20 0.43
JAK2 O60674 5/20 0.43
JAK3 P52333 5/20 0.43
PDE2A O00408 1/20 0.43
TYK2 P29597 4/20 0.42
BRD4 O60885 1/20 0.42
MCHR1 Q99705 1/20 0.42
POLB P06746 2/20 0.41
PLK1 P53350 1/20 0.41
UCHL1 P09936 1/20 0.41
PTGER4 P35408 1/20 0.41
RXFP1 Q9HBX9 1/20 0.41

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
SCHEMBL370914 0.89 NPBWR1 (0.48) NPBWR1L3MBTL1ALOX15MCHR1UCHL1
SCHEMBL369444 0.86 NPBWR1 (0.48) NPBWR1L3MBTL1ALOX15MCHR1POLB
SCHEMBL369974 0.86 NPBWR1 (0.48) NPBWR1L3MBTL1ALOX15MCHR1UCHL1
SCHEMBL371091 0.83 NPBWR1 (0.45) NPBWR1L3MBTL1ALOX15MCHR1UCHL1
SCHEMBL370615 0.81 NPBWR1 (0.44) NPBWR1L3MBTL1ALOX15MCHR1UCHL1
SCHEMBL7982141 0.80 NPBWR1 (0.48) NPBWR1L3MBTL1ALOX15PDE2ABRD4
SCHEMBL30739057 0.78 NPC1 (0.42) NPBWR1L3MBTL1POLB
SCHEMBL30739173 0.76 NPC1 (0.42) NPBWR1L3MBTL1
SCHEMBL15130310 0.76 NPBWR1 (0.39) NPBWR1L3MBTL1ALOX15JAK1JAK2
SCHEMBL3357317 0.75 NPBWR1 (0.49) NPBWR1L3MBTL1ALOX15PDE2AMCHR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2595986-A2 NOVEL 2-AMINO-4-PYRAZOLYL-THIAZOLE DERIVATIVES AND THEIR USE AS ALLOSTERIC MODULATORS OF METABOTROPIC GLUTAMATE RECEPTORS Addex Pharma SA (CH) 2013-05-29 EP disclosed
WO-2012009009-A2 NOVEL 2-AMINO-4-PYRAZOLYL-THIAZOLE DERIVATIVES AND THEIR USE AS ALLOSTERIC MODULATORS OF METABOTROPIC GLUTAMATE RECEPTORS ADDEX PHARMA S.A. (CH) 2012-01-19 WO disclosed