SCHEMBL6673799

SCHEMBL6673799

CCSN1CNC(=O)c2[nH]cnc21

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GDA Q9Y2T3 1/20 0.33
PDE4A P27815 2/20 0.30
ADORA2A P29274 2/20 0.30
PDE4B Q07343 2/20 0.30
PDE4C Q08493 2/20 0.30
PDE4D Q08499 2/20 0.30
ADORA2B P29275 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
SCHEMBL6672677 0.86 XDH (0.34) GDAPDE4AADORA2APDE4BPDE4C
SCHEMBL6675407 0.85 XDH (0.36) GDAPDE4AADORA2APDE4BPDE4C
SCHEMBL6672658 0.84 XDH (0.37) PDE4AADORA2APDE4BPDE4CPDE4D
SCHEMBL6675463 0.84
SCHEMBL6673659 0.80 ABL1 (0.40) ADORA2B
SCHEMBL6673121 0.77 GDA (0.36) GDAPDE4AADORA2APDE4BPDE4C
SCHEMBL6676174 0.75 HPRT1 (0.38) GDAPDE4AADORA2APDE4BPDE4C
SCHEMBL6674432 0.74 GDA (0.38) GDAPDE4AADORA2APDE4BPDE4C
SCHEMBL6674159 0.74 GDA (0.32) GDAADORA2AADORA2B
SCHEMBL6673897 0.72 PDE4A (0.38) GDAPDE4AADORA2APDE4BPDE4C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1202628-B1 NOVEL HYPOXANTHINE AND THIOHYPOXANTHINE COMPOUNDS EURO CELTIQUE SA (LU) 2004-10-13 EP claimed
EP-1202628-A4 NOVEL HYPOXANTHINE AND THIOHYPOXANTHINE COMPOUNDS EURO CELTIQUE SA (LU) 2002-10-30 EP claimed
EP-1202628-A1 NOVEL HYPOXANTHINE AND THIOHYPOXANTHINE COMPOUNDS Euro-Celtique S.A. (LU) 2002-05-08 EP claimed
WO-2001011967-A1 NOVEL HYPOXANTHINE AND THIOHYPOXANTHINE COMPOUNDS EURO-CELTIQUE S.A. (LU) 2001-02-22 WO claimed
EP-1202628-B1 NOVEL HYPOXANTHINE AND THIOHYPOXANTHINE COMPOUNDS EURO CELTIQUE SA (LU) 2004-10-13 EP disclosed
EP-1202628-A4 NOVEL HYPOXANTHINE AND THIOHYPOXANTHINE COMPOUNDS EURO CELTIQUE SA (LU) 2002-10-30 EP disclosed
EP-1202628-A1 NOVEL HYPOXANTHINE AND THIOHYPOXANTHINE COMPOUNDS Euro-Celtique S.A. (LU) 2002-05-08 EP disclosed
WO-2001011967-A1 NOVEL HYPOXANTHINE AND THIOHYPOXANTHINE COMPOUNDS EURO-CELTIQUE S.A. (LU) 2001-02-22 WO disclosed