SCHEMBL7366074

SCHEMBL7366074

COc1ccc(-c2nn(Cc3ccccc3)c(=O)c3cccnc23)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 3/20 0.55
PDE4B Q07343 3/20 0.55
PDE4C Q08493 3/20 0.55
PDE4D Q08499 3/20 0.55
PDE3B Q13370 1/20 0.55
PDE3A Q14432 1/20 0.55
ALDH1A1 P00352 6/20 0.55
NPSR1 Q6W5P4 3/20 0.53
CYP1A2 P05177 3/20 0.53
CYP3A4 P08684 3/20 0.53
CYP2C9 P11712 3/20 0.53
CYP2C19 P33261 3/20 0.53
PSMB1 P20618 1/20 0.52
PSMB5 P28074 1/20 0.52
KDM4E B2RXH2 2/20 0.49
HPGD P15428 1/20 0.49
HTT P42858 2/20 0.48
CYP2D6 P10635 2/20 0.48
LMNA P02545 1/20 0.48
MAPT P10636 2/20 0.47

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
SCHEMBL7365157 0.92 PDE4A (0.66) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL7366890 0.91 PDE4A (0.55) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL7362292 0.89 PDE4A (0.51) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL7365917 0.88 ALDH1A1 (0.70) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL7366870 0.88 PDE4A (0.63) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL7363014 0.87 ALDH1A1 (0.59) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL7365416 0.86 ALDH1A1 (0.50) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL7367052 0.85 F2RL3 (0.53) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL7369334 0.84 ALDH1A1 (0.48) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL7361643 0.83 PDE4A (0.54) PDE4APDE4BPDE4CPDE4DPDE3B

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