SCHEMBL7370618

SCHEMBL7370618

CCn1nc(-c2ccc(C)cc2)c2ncccc2c1=O

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 1/20 0.51
TBXAS1 P24557 1/20 0.51
PDE4A P27815 3/20 0.48
PDE4B Q07343 1/20 0.48
PDE4C Q08493 1/20 0.48
PDE4D Q08499 1/20 0.48
PDE3B Q13370 1/20 0.48
PDE3A Q14432 1/20 0.48
ALDH1A1 P00352 2/20 0.47
MAPT P10636 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
MEN1 O00255 3/20 0.46
KMT2A Q03164 3/20 0.46
GAA P10253 1/20 0.46
ADORA1 P30542 2/20 0.45
ADORA3 P0DMS8 1/20 0.45
TP53 P04637 1/20 0.45
ADORA2A P29274 1/20 0.44

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
SCHEMBL7370566 0.90 MEN1 (0.51) RAB9APDE4APDE4BPDE4CPDE4D
SCHEMBL7372162 0.90 RAB9A (0.51) RAB9ATBXAS1PDE4APDE4BPDE4C
SCHEMBL7365416 0.86 ALDH1A1 (0.50) RAB9ATBXAS1PDE4APDE4BPDE4C
SCHEMBL7363014 0.85 ALDH1A1 (0.59) RAB9APDE4APDE4BPDE4CPDE4D
SCHEMBL7365898 0.85 PDE4B (0.49) RAB9ATBXAS1PDE4APDE4BPDE4C
SCHEMBL7363949 0.84 TBXAS1 (0.46) RAB9ATBXAS1PDE4APDE4BPDE4C
SCHEMBL7362892 0.84 PDE4A (0.69) RAB9APDE4APDE4BPDE4CPDE4D
SCHEMBL7364707 0.82 HPGD (0.52) TBXAS1PDE4APDE4BPDE4CPDE4D
SCHEMBL7368776 0.82 NCOA1 (0.46) TBXAS1PDE4APDE4BPDE4CPDE4D
SCHEMBL7370523 0.81 PDE4A (0.53) RAB9APDE4APDE4BPDE4CPDE4D

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