SCHEMBL20530360

SCHEMBL20530360

Cc1cc(-c2ccc3nnn(Cc4cccc5cccnc45)c3n2)ccc1C(N)=O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC22A12 Q96S37 1/20 0.40
MKNK2 Q9HBH9 2/20 0.39
MKNK1 Q9BUB5 1/20 0.39
PARP1 P09874 2/20 0.38
PSEN1 P49768 1/20 0.37
PSEN2 P49810 1/20 0.37
KCNH2 Q12809 1/20 0.37
APH1B Q8WW43 1/20 0.37
NCSTN Q92542 1/20 0.37
APH1A Q96BI3 1/20 0.37
PSENEN Q9NZ42 1/20 0.37
MET P08581 8/20 0.37
AR P10275 1/20 0.36
ADORA2A P29274 1/20 0.35
ADORA1 P30542 1/20 0.35
GPR52 Q9Y2T5 1/20 0.35
PIK3C2B O00750 1/20 0.35
TGFBR1 P36897 1/20 0.35
SYK P43405 1/20 0.34
PLK4 O00444 1/20 0.34

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
SCHEMBL20530328 0.90 MKNK2 (0.39) SLC22A12MKNK2MKNK1PARP1PSEN1
SCHEMBL20530371 0.90 MET (0.43) SLC22A12PARP1METADORA2AADORA1
SCHEMBL20530305 0.89 PARP1 (0.39) SLC22A12MKNK2PARP1PSEN1PSEN2
SCHEMBL20530291 0.88 PARP1 (0.38) SLC22A12MKNK2PARP1METADORA2A
SCHEMBL20530304 0.87 ADORA2A (0.38) SLC22A12PARP1METADORA2AADORA1
SCHEMBL20530354 0.87 AR (0.39) SLC22A12MKNK2MKNK1PARP1MET
SCHEMBL20530285 0.86 PDE4A (0.39) SLC22A12PARP1METARADORA2A
SCHEMBL22729912 0.85 MET (0.35) SLC22A12PSEN1PSEN2KCNH2APH1B
SCHEMBL22729940 0.85 MET (0.35) SLC22A12PSEN1PSEN2KCNH2APH1B
SCHEMBL22729949 0.85 MET (0.35) SLC22A12PSEN1PSEN2KCNH2APH1B

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