SCHEMBL6818384

SCHEMBL6818384

COC(=O)Nc1cc2onc(C(=O)Nc3ccc(C#N)cc3C(=O)O)c2cc1-c1cnccn1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALB P02768 2/20 0.39
PDE10A Q9Y233 2/20 0.35
GSK3A P49840 2/20 0.34
GSK3B P49841 2/20 0.34
PORCN Q9H237 2/20 0.34
PPARG P37231 2/20 0.33
HIF1A Q16665 2/20 0.33
HCRTR1 O43613 1/20 0.32
HCRTR2 O43614 1/20 0.32
TP53 P04637 1/20 0.32
POLB P06746 1/20 0.32
MAPT P10636 1/20 0.32
CYP3A4 P08684 1/20 0.31
F10 P00742 1/20 0.31
GAK O14976 1/20 0.31
STK16 O75716 1/20 0.31
PIM1 P11309 1/20 0.31
AXL P30530 1/20 0.31
NEK2 P51955 1/20 0.31
STK3 Q13188 1/20 0.31

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
SCHEMBL6818175 0.92 ALB (0.36) ALBPDE10AGSK3AGSK3BPORCN
SCHEMBL6817836 0.90 ALB (0.38) ALBPDE10AGSK3AGSK3BHIF1A
SCHEMBL6821949 0.90 ALB (0.37) ALBPDE10AGSK3AGSK3BPORCN
SCHEMBL6818941 0.87 ALB (0.37) ALBPDE10AGSK3AGSK3BPPARG
SCHEMBL6819350 0.85 HIF1A (0.39) ALBGSK3AGSK3BHIF1APOLB
SCHEMBL6818579 0.83 HIF1A (0.38) ALBGSK3AGSK3BHIF1ATP53
SCHEMBL6814223 0.83 HIF1A (0.40) ALBGSK3AGSK3BHIF1APOLB
SCHEMBL6818723 0.82 EGLN2 (0.38) ALBHIF1ATP53POLBMAPT
SCHEMBL6818611 0.82 KDM4E (0.37) ALBPDE10AGSK3AGSK3BHIF1A
SCHEMBL6821275 0.81 HIF1A (0.38) ALBGSK3AGSK3BHIF1ATP53

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
WO-2004018428-A1 ANTIBACTERIAL BENZOIC ACID DERIVATIVES PHARMACIA & UPJOHN COMPANY LLC (US) 2004-03-04 WO disclosed