SCHEMBL5763422

SCHEMBL5763422

Cc1cc(C(=O)N(C)C)cc2c(Nc3cccc4c3CCO4)c(C(N)=O)cnc12

nearest known ligand 0.57

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 8/20 0.57
CSF1R P07333 4/20 0.40
EED O75530 3/20 0.39
SUZ12 Q15022 3/20 0.39
EZH2 Q15910 3/20 0.39
MTNR1B P49286 1/20 0.38
THRB P10828 1/20 0.37
PDE4A P27815 1/20 0.36
PDE4C Q08493 1/20 0.36
PDE4D Q08499 1/20 0.36

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
SCHEMBL5765629 0.88 PDE4B (0.51) PDE4BCSF1RMTNR1BTHRB
SCHEMBL2479861 0.88 PDE4B (0.58) PDE4BEEDSUZ12EZH2PDE4A
SCHEMBL31020770 0.86 PDE4B (0.61) PDE4BCSF1RMTNR1BTHRB
SCHEMBL5457430 0.85 PDE4B (0.55) PDE4BCSF1R
SCHEMBL5404792 0.85 PDE4B (0.51) PDE4BCSF1RMTNR1BPDE4APDE4C
SCHEMBL5763692 0.85 PDE4B (0.54) PDE4BCSF1R
SCHEMBL8305598 0.85 PDE4B (0.54) PDE4BCSF1RMTNR1B
SCHEMBL5405232 0.85 PDE4B (0.54) PDE4BCSF1RMTNR1B
SCHEMBL2505851 0.84 PDE4B (0.59) PDE4BCSF1RMTNR1BTHRB
SCHEMBL1275589 0.84 PDE4B (0.75) PDE4BCSF1R

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-1673345-A1 DERIVATIVES OF 3-AMINOCARBONYLQUINOLINE, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND PROCESSES AND INTERMEDIATES FOR THEIR PREPARATION GLAXO GROUP LIMITED (GB) 2006-06-28 EP disclosed
WO-2005030725-A1 DERIVATIVES OF 3-AMINOCARBONYLQUINOLINE, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND PROCESSES AND INTERMEDIATES FOR THEIR PREPARATION GLAXO GROUP LIMITED (GB) 2005-04-07 WO disclosed