SCHEMBL3470588

SCHEMBL3470588

COc1ccc(-c2ccc3c(c2)CCC3=O)c2nc(C3(C(=O)O)CC3)nn12

nearest known ligand 0.53

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PDE4D Q08499 20/20 0.53
PDE4A P27815 1/20 0.40
PDE4B Q07343 1/20 0.40
PDE4C Q08493 1/20 0.40

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
SCHEMBL508678 0.89 PDE4D (0.45) PDE4DPDE4APDE4BPDE4C
SCHEMBL508679 0.86 PDE4D (0.46) PDE4DPDE4APDE4BPDE4C
SCHEMBL508147 0.85 PDE4D (0.58) PDE4DPDE4APDE4BPDE4C
SCHEMBL16435086 0.85 PDE4D (0.73) PDE4DPDE4APDE4BPDE4C
SCHEMBL509437 0.83 PDE4D (0.44) PDE4DPDE4APDE4BPDE4C
SCHEMBL3469295 0.83 PDE4D (0.76) PDE4DPDE4APDE4BPDE4C
SCHEMBL7925787 0.83 PDE4D (0.48) PDE4DPDE4APDE4BPDE4C
SCHEMBL3469538 0.82 PDE4D (0.45) PDE4DPDE4A
SCHEMBL17571372 0.81 PDE4D (0.39) PDE4DPDE4APDE4BPDE4C
SCHEMBL509452 0.80 PDE4D (0.70) PDE4D

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 6 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 claimed
US-8952162-B2 Triazolopyridines as phosphodiesterase inhibitors for treatment of dermal diseases LEO PHARMA A/S (DK) 2015-02-10 US claimed
WO-2010069322-A1 TRIAZOLOPYRIDINES AS PHOSPHODIESTERASE INHIBITORS FOR TREATMENT OF DERMAL DISEASES LEO PHARMA A/S (DK) 2010-06-24 WO claimed
EP-2379548-B1 TRIAZOLOPYRIDINES AS PHOSPHODIESTERASE INHIBITORS FOR TREATMENT OF DERMAL DISEASES LEO PHARMA AS (DK) 2016-03-09 EP disclosed
US-8952162-B2 Triazolopyridines as phosphodiesterase inhibitors for treatment of dermal diseases LEO PHARMA A/S (DK) 2015-02-10 US disclosed
WO-2010069322-A1 TRIAZOLOPYRIDINES AS PHOSPHODIESTERASE INHIBITORS FOR TREATMENT OF DERMAL DISEASES LEO PHARMA A/S (DK) 2010-06-24 WO disclosed