SCHEMBL17772015

SCHEMBL17772015

COc1c(OC(F)F)ccc(C(=O)Cc2c(Cl)cncc2Cl)c1OC

nearest known ligand 0.78

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PDE4D Q08499 17/20 0.78
PDE4A P27815 4/20 0.57
PDE4B Q07343 1/20 0.57
PDE4C Q08493 1/20 0.57

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
SCHEMBL1434359 0.88 PDE4D (0.74) PDE4DPDE4APDE4BPDE4C
SCHEMBL1434490 0.88 PDE4D (1.00) PDE4DPDE4APDE4BPDE4C
SCHEMBL1434113 0.84 PDE4D (0.70) PDE4DPDE4APDE4BPDE4C
SCHEMBL17772017 0.84 PDE4A (0.58) PDE4DPDE4APDE4BPDE4C
SCHEMBL885393 0.81 PDE4D (0.81) PDE4DPDE4APDE4BPDE4C
SCHEMBL17772016 0.80 PDE4D (0.76) PDE4DPDE4APDE4BPDE4C
SCHEMBL885255 0.80 PDE4D (1.00) PDE4DPDE4APDE4BPDE4C
SCHEMBL1434257 0.80 PDE4D (0.78) PDE4DPDE4APDE4BPDE4C
SCHEMBL1031648 0.79 PDE4D (0.80) PDE4DPDE4APDE4BPDE4C
SCHEMBL1434091 0.78 PDE4D (0.80) 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-3070091-A1 BENZODIOXOLE DERIVATIVES AS PHOSPHODIESTERASE INHIBITORS LEO PHARMA A/S (DK) 2016-09-21 EP disclosed
EP-2585469-B1 BENZODIOXOLE OR BENZODIOXEPINE HETEROCYCLIC COMPOUNDS AS PHOSPHODIESTERASE INHIBITORS LEO PHARMA AS (DK) 2016-05-25 EP disclosed