SCHEMBL7365898

SCHEMBL7365898

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

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 3/20 0.49
HPGD P15428 2/20 0.49
TBXAS1 P24557 1/20 0.47
PDE4A P27815 5/20 0.45
PDE4C Q08493 2/20 0.45
PDE4D Q08499 2/20 0.45
PDE3B Q13370 1/20 0.45
PDE3A Q14432 1/20 0.45
ADORA1 P30542 2/20 0.44
KAT2B Q92831 1/20 0.44
ADORA3 P0DMS8 1/20 0.44
RAB9A P51151 1/20 0.44
MAPT P10636 1/20 0.44
ALOX15 P16050 1/20 0.43
GAA P10253 2/20 0.42
RORC P51449 1/20 0.42
KDM4E B2RXH2 1/20 0.42
USP2 O75604 1/20 0.42
TP53 P04637 1/20 0.42
TSHR P16473 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
SCHEMBL7369488 0.91 HPGD (0.50) PDE4BHPGDPDE4APDE4CPDE4D
SCHEMBL7370613 0.91 HPGD (0.52) PDE4BHPGDTBXAS1PDE4APDE4C
SCHEMBL7363949 0.89 TBXAS1 (0.46) PDE4BHPGDTBXAS1PDE4APDE4C
SCHEMBL7364707 0.87 HPGD (0.52) PDE4BHPGDTBXAS1PDE4APDE4C
SCHEMBL7368776 0.87 NCOA1 (0.46) PDE4BHPGDTBXAS1PDE4APDE4C
SCHEMBL7361626 0.86 ALDH1A1 (0.56) PDE4BHPGDPDE4APDE4CPDE4D
SCHEMBL7370618 0.85 RAB9A (0.51) PDE4BTBXAS1PDE4APDE4CPDE4D
SCHEMBL7364240 0.84 PDE4A (0.66) PDE4BHPGDPDE4APDE4CPDE4D
SCHEMBL7365416 0.82 ALDH1A1 (0.50) PDE4BHPGDTBXAS1PDE4APDE4C
SCHEMBL7360999 0.81 HPGD (0.53) HPGDPDE4AKAT2BRAB9AMAPT

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