SCHEMBL8485408

SCHEMBL8485408

Cn1[c]nc2ccncc21

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NFATC1 O95644 2/20 0.36
GSK3B P49841 2/20 0.36
DYRK1A Q13627 2/20 0.36
MAPT P10636 7/20 0.34
ATM Q13315 1/20 0.34
PDE2A O00408 2/20 0.33
PDE4D Q08499 1/20 0.33
PDE11A Q9HCR9 1/20 0.33
PDE10A Q9Y233 1/20 0.33
USP2 O75604 1/20 0.31
HTT P42858 1/20 0.31
NCOA1 Q15788 1/20 0.31
NCOA3 Q9Y6Q9 1/20 0.31
KCNH2 Q12809 1/20 0.31
AOC3 Q16853 1/20 0.31
ADORA3 P0DMS8 1/20 0.31
ADORA2A P29274 1/20 0.31
RPS6KA5 O75582 1/20 0.31
CYP19A1 P11511 1/20 0.30
NPC1 O15118 1/20 0.30

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
SCHEMBL5982299 0.84 ATM (0.41) NFATC1GSK3BDYRK1AMAPTATM
SCHEMBL8484476 0.76 RPS6KA5 (0.37) NFATC1GSK3BDYRK1AMAPTPDE2A
SCHEMBL75687 0.72 SLC9A1 (0.43) MAPTATMHTTNPC1TP53
SCHEMBL2157981 0.68 CYP11B1 (0.39) ATMPDE2APDE10A
SCHEMBL7814408 0.67 NPM1 (0.35) MAPTPDE2APDE10AUSP2HTT
SCHEMBL5982654 0.67 PTPN1 (0.42) DYRK1AMAPTPDE2APDE10ANPC1
SCHEMBL822544 0.66 ATM (0.42) NFATC1GSK3BDYRK1AMAPTATM
SCHEMBL10328043 0.65 SLC9A1 (0.55) NFATC1GSK3BDYRK1AMAPTATM
SCHEMBL84793 0.65 LTA4H (0.41) NFATC1GSK3BDYRK1AMAPT
SCHEMBL7811025 0.64 SCN10A (0.35) MAPTKCNH2NPC1RAB9A

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
US-5977365-A HYPOGLYCEMIC AGENTS SANKYO COMPANY, LIMITED (JP) 1999-11-02 US disclosed
US-5624935-A ANTIDIABETIC AGENTS, HYPOGLYCEMIC AGENTS OR ANTILIPEMIC AGENTS SANKYO COMPANY, LIMITED 1997-04-29 US disclosed