SCHEMBL1747461

SCHEMBL1747461

CS(=O)(=O)c1cc(C2CC2)nc2c1C(=O)NCC2

nearest known ligand 0.49

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 18/20 0.49
PDE4A P27815 3/20 0.40
PDE4C Q08493 3/20 0.40
PDE4D Q08499 3/20 0.40
TLR8 Q9NR97 1/20 0.34
NR1H2 P55055 1/20 0.32
NR1H3 Q13133 1/20 0.32

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
SCHEMBL1747319 0.78 PDE4B (0.49) PDE4BPDE4APDE4CPDE4D
SCHEMBL1747320 0.67 PDE4B (1.00) PDE4B
SCHEMBL1747312 0.64 PDE4B (0.51) PDE4BPDE4APDE4CPDE4D
SCHEMBL29965443 0.60 PDE4B (0.40) PDE4BPDE4APDE4CPDE4D
SCHEMBL21212158 0.60 TLR8 (0.43) TLR8NR1H2NR1H3
SCHEMBL8820190 0.60 TLR8 (0.54) TLR8
SCHEMBL22048859 0.59 HTR1A (0.36) PDE4B
SCHEMBL30150121 0.59 TLR8 (0.52) TLR8
SCHEMBL28930700 0.59 TLR8 (0.52) TLR8
SCHEMBL28677927 0.59 PDE4B (0.49) PDE4B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2380890-A1 New 7,8-dihydro-1,6-naphthyridin-5(6h)-one-derivatives as PDE4 inhibitors Almirall, S.A. (ES) 2011-10-26 EP disclosed
EP-2380890-A1 New 7,8-dihydro-1,6-naphthyridin-5(6h)-one-derivatives as PDE4 inhibitors Almirall, S.A. (ES) 2011-10-26 EP disclosed
US-20110253549-A1 WASHING APPARATUS AND METHOD OF DEODORIZING WASHING WATER KANNO MINORU 2011-10-20 US disclosed