SCHEMBL7363855

SCHEMBL7363855

COC(=O)c1cc(-c2nn(-c3ccccc3)c(=O)c3cccnc23)ccc1C

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 2/20 0.47
PDE4B Q07343 2/20 0.47
PDE4C Q08493 2/20 0.47
PDE4D Q08499 2/20 0.47
KDM4E B2RXH2 3/20 0.43
KMT2A Q03164 2/20 0.41
MEN1 O00255 1/20 0.41
ADORA3 P0DMS8 5/20 0.40
ALDH1A1 P00352 3/20 0.40
LMNA P02545 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
GAA P10253 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
STAT1 P42224 1/20 0.40
MAPK1 P28482 1/20 0.39
MAPT P10636 1/20 0.39
POLB P06746 1/20 0.39
HPGD P15428 1/20 0.39
HSD17B10 Q99714 1/20 0.39

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
SCHEMBL7363039 0.92 PDE4A (0.47) PDE4APDE4BPDE4CPDE4DKDM4E
SCHEMBL7363944 0.85 ALDH1A1 (0.54) PDE4APDE4BPDE4CPDE4DKDM4E
SCHEMBL7363279 0.84 GRM5 (0.48) PDE4APDE4BPDE4CPDE4DKDM4E
SCHEMBL7370274 0.84 PDE4A (0.52) PDE4APDE4BPDE4CPDE4DKDM4E
SCHEMBL7369403 0.83 KDM4E (0.44) PDE4AKDM4EALDH1A1LMNAL3MBTL1
SCHEMBL7365735 0.83 PDE4A (0.44) PDE4APDE4BPDE4CPDE4DKDM4E
SCHEMBL7365395 0.79 PDE4A (0.61) PDE4APDE4BPDE4CPDE4DKDM4E
SCHEMBL7366959 0.79 L3MBTL1 (0.58) PDE4APDE4BPDE4CPDE4DKDM4E
SCHEMBL7359750 0.78 PDE4A (0.50) PDE4APDE4BPDE4CPDE4DKDM4E
SCHEMBL7364352 0.78 KMT2A (0.48) PDE4APDE4BPDE4CPDE4DKDM4E

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-0612321-A1 PYRIDO PYRIDAZINONE AND PYRIDAZINTHIONE COMPOUNDS WITH PDE IV INHIBITING ACTIVITY SYNTEX (U.S.A.) INC. (US) 1994-08-31 EP disclosed
WO-1993007146-A1 BENZO AND PYRIDO PYRIDAZINONE AND PYRIDAZINTHIONE COMPOUNDS WITH PDE IV INHIBITING ACTIVITY SYNTEX (U.S.A.) INC. (US) 1993-04-15 WO disclosed