SCHEMBL7019337

SCHEMBL7019337

CCc1cc2c(OC(=O)Nc3c(Cl)cc(C#N)cc3Cl)cnc(OC(F)F)c2o1

nearest known ligand 0.55

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PDE4D Q08499 14/20 0.55
PDE4B Q07343 14/20 0.55
PDE4A P27815 12/20 0.55
PDE4C Q08493 12/20 0.55
ABCB11 O95342 1/20 0.33
CETP P11597 1/20 0.31
PDE5A O76074 2/20 0.31
GPR6 P46095 1/20 0.31
NR3C1 P04150 1/20 0.30

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
SCHEMBL7016598 0.90 PDE4A (0.67) PDE4DPDE4BPDE4APDE4CCETP
SCHEMBL7015621 0.85 PDE4D (0.49) PDE4DPDE4BPDE4APDE4CABCB11
SCHEMBL7020449 0.85 PDE4A (0.76) PDE4DPDE4BPDE4APDE4CCETP
SCHEMBL7019078 0.80 PDE4A (0.44) PDE4DPDE4BPDE4APDE4C
SCHEMBL7015219 0.80 PDE4A (0.43) PDE4DPDE4BPDE4APDE4C
SCHEMBL7021594 0.78 PDE4D (0.59) PDE4DPDE4BPDE4APDE4C
SCHEMBL7017768 0.75 PDE4A (0.43) PDE4DPDE4BPDE4APDE4C
SCHEMBL7019218 0.75 PDE4B (0.49) PDE4DPDE4BPDE4APDE4C
SCHEMBL7020430 0.72 PDE4A (0.60) PDE4DPDE4BPDE4APDE4C
SCHEMBL7014555 0.71 PDE4A (0.75) PDE4DPDE4BPDE4APDE4C

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-1086106-B1 FUROPYRIDINE DERIVATIVES AND THEIR THERAPEUTICAL USE DARWIN DISCOVERY LTD (GB) 2003-08-20 EP claimed