SCHEMBL17210752

SCHEMBL17210752

COc1cc(I)ccc1OC1CCOCC1

nearest known ligand 0.55

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PDE4D Q08499 16/20 0.55
PDE4B Q07343 10/20 0.55
PDE4A P27815 10/20 0.55
PDE4C Q08493 9/20 0.55
SYK P43405 1/20 0.47
KAT2B Q92831 1/20 0.40
BAZ2B Q9UIF8 1/20 0.40
CHEK1 O14757 1/20 0.39

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
SCHEMBL14934301 0.91 PDE4D (0.57) PDE4DPDE4BPDE4APDE4CCHEK1
SCHEMBL10196382 0.83 SYK (0.67) PDE4DPDE4BPDE4APDE4CSYK
SCHEMBL14320848 0.81 PDE4D (0.55) PDE4DPDE4BPDE4APDE4CSYK
SCHEMBL12548302 0.79 SYK (0.44) PDE4DPDE4BPDE4APDE4CSYK
SCHEMBL1613268 0.79 SYK (0.44) PDE4DPDE4BPDE4APDE4CSYK
SCHEMBL882334 0.79 PDE4A (0.59) PDE4DPDE4BPDE4APDE4C
SCHEMBL28373126 0.78 ALDH1A1 (0.58) PDE4DPDE4BPDE4APDE4C
SCHEMBL523941 0.78 PDE4D (0.52) PDE4DPDE4BPDE4APDE4CSYK
SCHEMBL15595689 0.77 PDE4D (0.71) PDE4DPDE4BPDE4APDE4C
SCHEMBL274889 0.76 SYK (0.42) PDE4DPDE4BPDE4APDE4CSYK

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
EP-2528915-B1 SUBSTITUTED NAPHTHYRIDINES AND THEIR USE AS SYK KINASE INHIBITORS BOEHRINGER INGELHEIM INT (DE) 2015-10-28 EP disclosed