SCHEMBL20530285

SCHEMBL20530285

NC(=O)c1cccc(-c2ccc3nnn(Cc4cccc5cccnc45)c3n2)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 1/20 0.39
PDE4B Q07343 1/20 0.39
PDE4C Q08493 1/20 0.39
PDE4D Q08499 1/20 0.39
ADORA2A P29274 6/20 0.39
ADORA1 P30542 6/20 0.39
TGFBR1 P36897 3/20 0.39
ADORA3 P0DMS8 2/20 0.39
ADORA2B P29275 2/20 0.39
SLC22A12 Q96S37 1/20 0.38
MET P08581 4/20 0.38
AR P10275 1/20 0.38
PARP1 P09874 1/20 0.37
PDGFRA P16234 1/20 0.36
FLT1 P17948 1/20 0.36
FLT4 P35916 1/20 0.36
KDR P35968 1/20 0.36
PRKD1 Q15139 1/20 0.36
MAPK14 Q16539 1/20 0.36
FYN P06241 1/20 0.36

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
SCHEMBL20530354 0.91 AR (0.39) PDE4APDE4BPDE4CPDE4DADORA2A
SCHEMBL20530364 0.88 MAP4K4 (0.47) ADORA3SLC22A12METFYNHDAC6
SCHEMBL20530305 0.87 PARP1 (0.39) ADORA2AADORA1SLC22A12METPARP1
SCHEMBL20530371 0.86 MET (0.43) ADORA2AADORA1SLC22A12METPARP1
SCHEMBL20530291 0.86 PARP1 (0.38) ADORA2AADORA1SLC22A12METPARP1
SCHEMBL20530360 0.86 SLC22A12 (0.40) ADORA2AADORA1TGFBR1SLC22A12MET
SCHEMBL20530328 0.86 MKNK2 (0.39) ADORA2AADORA1SLC22A12METPARP1
SCHEMBL20530300 0.86 MET (0.40) ADORA2AADORA1ADORA3ADORA2BSLC22A12
SCHEMBL1329647 0.85 MET (0.57) TGFBR1MET
SCHEMBL20530312 0.84 MET (0.39) SLC22A12METFYN

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2571878-B1 NOVEL 3,5-DISUBSTITUED-3H-IMIDAZO[4,5-B]PYRIDINE AND 3,5- DISUBSTITUED -3H-[1,2,3]TRIAZOLO[4,5-B]PYRIDINE COMPOUNDS AS MODULATORS OF PROTEIN KINASES INCOZEN THERAPEUTICS PVT LTD (IN) 2018-10-17 EP claimed