SCHEMBL19806002

SCHEMBL19806002

COc1ccc(Cn2cc(-c3cc(-c4ccccc4F)nc(SC)n3)ccc2=O)cc1OC

nearest known ligand 0.53

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SDHB P21912 12/20 0.53
PTGDR Q13258 1/20 0.39
PDE4A P27815 1/20 0.39
PDE4B Q07343 1/20 0.39
PDE4C Q08493 1/20 0.39
PDE4D Q08499 1/20 0.39
UTS2R Q9UKP6 1/20 0.38
LMNA P02545 2/20 0.37
CREBBP Q92793 1/20 0.37

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
SCHEMBL22912302 0.89 SDHB (0.54) SDHBPDE4APDE4BPDE4CPDE4D
SCHEMBL21019932 0.87 SDHB (0.58) SDHBPTGDRPDE4APDE4BPDE4C
SCHEMBL29976590 0.87 SDHB (0.71) SDHB
SCHEMBL20985740 0.87 SDHB (0.71) SDHB
SCHEMBL26313101 0.84 SDHB (0.56) SDHBPTGDRPDE4APDE4BPDE4C
SCHEMBL19806091 0.83 SDHB (0.55) SDHBPTGDRPDE4APDE4BPDE4C
SCHEMBL19805843 0.83 SDHB (0.55) SDHBPTGDRPDE4APDE4BPDE4C
SCHEMBL23897424 0.82 SDHB (0.64) SDHB
SCHEMBL21019928 0.81 SDHB (0.53) SDHBPTGDRPDE4APDE4BPDE4C
SCHEMBL19806124 0.81 SDHB (0.49) SDHBPTGDRPDE4APDE4BPDE4C

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-2018014802-A1 APOPTOSIS INHIBITORS NATIONAL INSTITUTE OF BIOLOGICAL SCIENCES, BEIJING (CN) 2018-01-25 WO disclosed