SCHEMBL7369005

SCHEMBL7369005

COC(=O)c1ccc(-c2nn(Cc3ccncc3)c(=O)c3ncccc23)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 4/20 0.51
PDE4B Q07343 4/20 0.51
PDE4C Q08493 4/20 0.51
PDE4D Q08499 4/20 0.51
PDE3B Q13370 1/20 0.51
PDE3A Q14432 1/20 0.51
ALDH1A1 P00352 3/20 0.50
HPGD P15428 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
F2RL3 Q96RI0 1/20 0.47
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
USP2 O75604 1/20 0.43
MAPK10 P53779 1/20 0.43
TSHR P16473 1/20 0.43
KAT2B Q92831 1/20 0.42
NAMPT P43490 2/20 0.42
FAAH O00519 1/20 0.42
POLB P06746 1/20 0.42
GAA P10253 1/20 0.42

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
SCHEMBL7367645 0.93 F2RL3 (0.55) PDE4APDE4BPDE4CPDE4DALDH1A1
SCHEMBL7363603 0.92 PDE4A (0.61) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL7372566 0.89 PDE4A (0.58) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL7368362 0.88 PDE4A (0.54) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL7367921 0.87 PDE4A (0.53) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL7365662 0.86 HPGD (0.55) PDE4APDE4BPDE4CPDE4DALDH1A1
SCHEMBL7369760 0.86 PDE4A (0.51) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL7366365 0.86 PDE4A (0.52) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL7361643 0.85 PDE4A (0.54) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL7367052 0.85 F2RL3 (0.53) 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