SCHEMBL19119079

SCHEMBL19119079

CCc1nc(-c2ccc(F)c(OC)c2)nc2c1CCN2c1ccc(CC(=O)O)cc1

nearest known ligand 0.71

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ PDE4B Q07343 6/20 0.71
▸ PTGDR2 Q9Y5Y4 14/20 0.41
▸ PDE4D Q08499 2/20 0.41

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
SCHEMBL16447019 0.93 PDE4B (0.82) PDE4BPTGDR2PDE4D
SCHEMBL19118465 0.90 PDE4B (0.66) PDE4BPTGDR2PDE4D
SCHEMBL16446595 0.88 PDE4B (0.66) PDE4BPTGDR2PDE4D
SCHEMBL19118463 0.88 PDE4B (0.60) PDE4BPTGDR2PDE4D
SCHEMBL16446717 0.84 PDE4B (0.75) PDE4BPTGDR2PDE4D
SCHEMBL16446304 0.83 PDE4B (0.67) PDE4BPTGDR2PDE4D
SCHEMBL17784214 0.83 PDE4B (1.00) PDE4B
SCHEMBL16446846 0.82 PDE4B (0.73) PDE4BPDE4D
SCHEMBL19118469 0.81 PDE4B (0.54) PDE4B
SCHEMBL19118473 0.80 PDE4B (0.54) PDE4BPDE4D

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-3030565-B1 NOVEL SUBSTITUTED CONDENSED PYRIMIDINE COMPOUNDS GRUENENTHAL GMBH (DE) 2017-07-19 — — EP disclosed
Send feedback