SCHEMBL7367052

SCHEMBL7367052

COC(=O)c1ccc(-c2nn(Cc3ccccc3)c(=O)c3cccnc23)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F2RL3 Q96RI0 1/20 0.53
PDE4A P27815 3/20 0.52
PDE4B Q07343 3/20 0.52
PDE4C Q08493 3/20 0.52
PDE4D Q08499 3/20 0.52
PDE3B Q13370 1/20 0.52
PDE3A Q14432 1/20 0.52
ALDH1A1 P00352 4/20 0.51
HPGD P15428 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
CYP1A2 P05177 2/20 0.49
CYP3A4 P08684 2/20 0.49
CYP2C9 P11712 2/20 0.49
CYP2C19 P33261 2/20 0.49
NPSR1 Q6W5P4 2/20 0.49
TSHR P16473 1/20 0.46
ENPP1 P22413 1/20 0.45
MAPK10 P53779 1/20 0.45

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
SCHEMBL7363603 0.93 PDE4A (0.61) F2RL3PDE4APDE4BPDE4CPDE4D
SCHEMBL7367645 0.92 F2RL3 (0.55) F2RL3PDE4APDE4BPDE4CPDE4D
SCHEMBL7369998 0.89 PDE4A (0.48) F2RL3PDE4APDE4BPDE4CPDE4D
SCHEMBL7363086 0.89 PDE4A (0.59) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL9377772 0.89 HPGD (0.50) F2RL3PDE4APDE4BPDE4CPDE4D
SCHEMBL7361626 0.88 ALDH1A1 (0.56) F2RL3PDE4APDE4BPDE4CPDE4D
SCHEMBL7364707 0.87 HPGD (0.52) F2RL3PDE4APDE4BPDE4CPDE4D
SCHEMBL7365377 0.86 PDE4A (0.54) F2RL3PDE4APDE4BPDE4CPDE4D
SCHEMBL7365955 0.86 PDE4A (0.52) F2RL3PDE4APDE4BPDE4CPDE4D
SCHEMBL7370274 0.85 PDE4A (0.52) F2RL3PDE4APDE4BPDE4CPDE4D

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