SCHEMBL4958910

SCHEMBL4958910

O=C(NCCc1ccc[nH]c1=O)c1ccnc2[nH]c(-c3ccsc3)nc12

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 5/20 0.45
GSK3A P49840 1/20 0.45
HIF1A Q16665 1/20 0.40
MET P08581 1/20 0.39
CHEK2 O96017 3/20 0.37
CHEK1 O14757 2/20 0.37
MEN1 O00255 1/20 0.37
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
KMT2A Q03164 1/20 0.37
P2RX7 Q99572 3/20 0.36
RAD52 P43351 1/20 0.35
UHRF1 Q96T88 1/20 0.35
PBK Q96KB5 3/20 0.35
SLC40A1 Q9NP59 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
SCHEMBL4959665 0.88 GSK3B (0.48) GSK3BHIF1AMEN1NPC1RAB9A
SCHEMBL4166883 0.86 GSK3B (0.47) GSK3BGSK3AHIF1AMETCHEK2
SCHEMBL4960805 0.86 GSK3B (0.45) GSK3BGSK3AHIF1AMETCHEK2
SCHEMBL4160359 0.85 GSK3B (0.49) GSK3BGSK3AHIF1AMETCHEK2
SCHEMBL4958340 0.85 GSK3B (0.55) GSK3BHIF1AMEN1NPC1RAB9A
SCHEMBL4957874 0.85 PBK (0.51) GSK3BPBK
SCHEMBL4169222 0.83 GSK3B (0.44) GSK3BGSK3AHIF1AMETCHEK2
SCHEMBL4961799 0.82 GSK3B (0.42) GSK3BMEN1NPC1RAB9AKMT2A
SCHEMBL4144878 0.81 GSK3B (0.47) GSK3BGSK3AMETMEN1NPC1
SCHEMBL4167099 0.81 GSK3B (0.55) GSK3BGSK3AHIF1ANPC1RAB9A

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-1984370-A1 IMIDAZOPYRIDINE DERIVATIVES INHIBITING PROTEIN KINASE ACTIVITY, METHOD FOR THE PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITION CONTAINING SAME Crystalgenomics, Inc. (KR) 2008-10-29 EP claimed
WO-2007083978-A1 IMIDAZOPYRIDINE DERIVATIVES INHIBITING PROTEIN KINASE ACTIVITY, METHOD FOR THE PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITION CONTAINING SAME CRYSTALGENOMICS, INC. (KR) 2007-07-26 WO claimed