SCHEMBL7363086

SCHEMBL7363086

COC(=O)c1cccc(-c2nn(Cc3ccccc3)c(=O)c3cccnc23)c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 6/20 0.59
PDE4B Q07343 4/20 0.59
PDE4C Q08493 4/20 0.59
PDE4D Q08499 4/20 0.59
PDE3B Q13370 1/20 0.59
PDE3A Q14432 1/20 0.59
MAPK10 P53779 1/20 0.52
ALDH1A1 P00352 4/20 0.48
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
ABHD6 Q9BV23 1/20 0.45
GAA P10253 1/20 0.44
PKM P14618 1/20 0.44
TSHR P16473 2/20 0.43
PPIA P62937 1/20 0.43
LMNA P02545 2/20 0.43
NPSR1 Q6W5P4 2/20 0.43
CYP1A2 P05177 1/20 0.43
CYP3A4 P08684 1/20 0.43
CYP2D6 P10635 1/20 0.43

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
SCHEMBL7368670 0.93 PDE4A (0.69) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL7359391 0.92 MAPK10 (0.50) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL7370625 0.90 PDE4A (0.55) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL7367052 0.89 F2RL3 (0.53) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL7362649 0.88 PDE4A (0.50) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL7372566 0.86 PDE4A (0.58) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL7370274 0.85 PDE4A (0.52) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL7366870 0.84 PDE4A (0.63) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL7363279 0.83 GRM5 (0.48) PDE4APDE4BPDE4CPDE4DALDH1A1
SCHEMBL7363603 0.82 PDE4A (0.61) 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