SCHEMBL18258688

SCHEMBL18258688

[CH2]CCc1cccc(-c2cccc(Oc3ncc(F)cc3C(=O)N[C@H]3CC[C@H](NC(=O)c4csc(C)n4)CC3)c2)c1

nearest known ligand 0.76

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 20/20 0.76

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
SCHEMBL18258687 1.00 PDE4B (0.76) PDE4B
SCHEMBL16026688 0.95 PDE4B (0.82) PDE4B
SCHEMBL16026690 0.95 PDE4B (0.82) PDE4B
SCHEMBL3201487 0.92 PDE4B (0.75) PDE4B
SCHEMBL3201493 0.92 PDE4B (0.75) PDE4B
SCHEMBL16026542 0.91 PDE4B (0.84) PDE4B
SCHEMBL16026540 0.91 PDE4B (0.84) PDE4B
SCHEMBL3219022 0.88 PDE4B (0.83) PDE4B
SCHEMBL3219027 0.88 PDE4B (0.83) PDE4B
SCHEMBL3192757 0.88 PDE4B (0.72) PDE4B

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-2778156-B1 Phenoxypyridinylamide derivatives and their use in the treatment of PDE4 mediated disease states ASTRAZENECA AB (SE) 2016-11-30 EP disclosed