SCHEMBL7926846

SCHEMBL7926846

C=C(NC(C)C)C1(c2nc3c(OC)ccc(-c4cccc5c4CCC5=O)n3n2)CC1

nearest known ligand 0.58

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PDE4D Q08499 19/20 0.58
PDE4A P27815 2/20 0.43
PDE4B Q07343 1/20 0.43
PDE4C Q08493 1/20 0.43

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
SCHEMBL508469 0.91 PDE4D (0.63) PDE4DPDE4APDE4BPDE4C
SCHEMBL7919033 0.85 PDE4D (0.55) PDE4DPDE4A
SCHEMBL3469123 0.85 PDE4D (0.65) PDE4DPDE4A
SCHEMBL7924211 0.83 PDE4D (0.59) PDE4DPDE4APDE4BPDE4C
SCHEMBL17554735 0.82 PDE4D (0.68) PDE4D
SCHEMBL17554738 0.82 PDE4D (0.71) PDE4D
SCHEMBL508470 0.81 PDE4D (0.64) PDE4DPDE4A
SCHEMBL510097 0.80 PDE4D (0.60) PDE4DPDE4A
SCHEMBL509333 0.79 PDE4D (0.62) PDE4DPDE4A
SCHEMBL508750 0.78 PDE4D (0.60) PDE4DPDE4APDE4BPDE4C

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
EP-2379548-B1 TRIAZOLOPYRIDINES AS PHOSPHODIESTERASE INHIBITORS FOR TREATMENT OF DERMAL DISEASES LEO PHARMA AS (DK) 2016-03-09 EP disclosed
WO-2010069322-A1 TRIAZOLOPYRIDINES AS PHOSPHODIESTERASE INHIBITORS FOR TREATMENT OF DERMAL DISEASES LEO PHARMA A/S (DK) 2010-06-24 WO disclosed