SCHEMBL2829346

SCHEMBL2829346

CCn1nc(C(=O)O)c(Cc2ccc(Br)cc2)c(Nc2cnccc2C)c1=O

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM4C Q9H3R0 4/20 0.36
FPR1 P21462 4/20 0.36
FPR2 P25090 4/20 0.36
PDE4B Q07343 6/20 0.34
PDE4A P27815 3/20 0.34
PDE4C Q08493 3/20 0.34
PDE4D Q08499 3/20 0.34
PDE3B Q13370 2/20 0.33
PDE3A Q14432 2/20 0.33
P2RX7 Q99572 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
ADORA1 P30542 1/20 0.32

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 0.92 KDM4C (0.38) KDM4CPDE4BPDE4APDE4CPDE4D
SCHEMBL2829340 0.86 KDM4C (0.41) KDM4CPDE4BPDE4APDE4CPDE4D
SCHEMBL2828108 0.85 KDM4C (0.41) KDM4CFPR1FPR2PDE4BPDE4A
SCHEMBL2826007 0.85 KDM4C (0.35) KDM4CPDE4BPDE4APDE4CPDE4D
SCHEMBL2829407 0.84 FPR2 (0.40) FPR1FPR2PDE4BSMN1; SMN2
SCHEMBL2829015 0.83 ALDH1A1 (0.46) FPR1FPR2P2RX7
SCHEMBL2828384 0.83 SMN1; SMN2 (0.38) PDE4BSMN1; SMN2ADORA1
SCHEMBL1997196 0.82 PDE4B (0.34) KDM4CPDE4BPDE4APDE4CPDE4D
SCHEMBL2828114 0.82 ROCK2 (0.39) KDM4C
SCHEMBL2826438 0.82 GPR52 (0.39) KDM4C

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