SCHEMBL2829340

SCHEMBL2829340

CCc1c(C(=O)O)nn(CC)c(=O)c1Nc1cnccc1C

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KDM4C Q9H3R0 9/20 0.41
KDM5A P29375 1/20 0.37
PDE4B Q07343 5/20 0.36
PDE4A P27815 4/20 0.36
PDE4C Q08493 4/20 0.36
PDE4D Q08499 4/20 0.36
KDM6B O15054 2/20 0.35
P2RX7 Q99572 1/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
CYP1A2 P05177 1/20 0.35

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
SCHEMBL2828120 0.89 KDM4C (0.38) KDM4CPDE4BPDE4APDE4CPDE4D
SCHEMBL2829346 0.86 KDM4C (0.36) KDM4CPDE4BPDE4APDE4CPDE4D
SCHEMBL1997947 0.86 PDE4B (0.45) KDM4CPDE4BKDM6BP2RX7SMN1; SMN2
SCHEMBL2825391 0.85 KDM4C (0.40) KDM4CPDE4BKDM6BP2RX7SMN1; SMN2
SCHEMBL2826007 0.85 KDM4C (0.35) KDM4CPDE4BPDE4APDE4CPDE4D
SCHEMBL2828388 0.85 PDE4B (0.39) KDM4CPDE4BPDE4APDE4CPDE4D
SCHEMBL2828108 0.85 KDM4C (0.41) KDM4CPDE4BPDE4APDE4CPDE4D
SCHEMBL2829015 0.82 ALDH1A1 (0.46) P2RX7
SCHEMBL2823459 0.82 KDM4C (0.38) KDM4CPDE4BKDM6BSMN1; SMN2CYP1A2
SCHEMBL2828691 0.81 PDE4B (0.42) PDE4BPDE4APDE4CPDE4DSMN1; SMN2

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-1758869-B1 PYRIDAZIN-3(2H)-ONE DERIVATIVES AND THEIR USE AS PDE4 INHIBITORS ALMIRALL SA (ES) 2010-12-22 EP claimed