SCHEMBL10965403

SCHEMBL10965403

CCC(C)Oc1cccc(-c2ccc(=O)[nH]n2)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.48
PDE4A P27815 3/20 0.46
PDE4B Q07343 3/20 0.46
PDE4C Q08493 3/20 0.46
PDE4D Q08499 3/20 0.46
LMNA P02545 3/20 0.46
PDE3B Q13370 3/20 0.45
PDE3A Q14432 3/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
TP53 P04637 2/20 0.45
CYP2C9 P11712 1/20 0.45
HPGD P15428 1/20 0.45
TSHR P16473 1/20 0.45
MAPK1 P28482 1/20 0.45
CYP2C19 P33261 1/20 0.45
BLM P54132 1/20 0.45
PMP22 Q01453 1/20 0.45
MAPT P10636 5/20 0.44
GAA P10253 2/20 0.44
MEN1 O00255 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
SCHEMBL10968704 0.84 LMNA (0.61) CYP1A2PDE4APDE4BPDE4CPDE4D
SCHEMBL7367927 0.81 PDE3B (0.59) CYP1A2PDE4APDE4BPDE4CPDE4D
SCHEMBL10967551 0.81 MAPT (0.60) CYP1A2PDE4APDE4BPDE4CPDE4D
SCHEMBL10966475 0.79 CYP1A2 (0.50) CYP1A2PDE4APDE4BPDE4CPDE4D
SCHEMBL10758345 0.78 PDE4A (0.72) CYP1A2PDE4APDE4BPDE4CPDE4D
SCHEMBL3159466 0.75 CYP1A2 (0.65) CYP1A2PDE4APDE4BPDE4CPDE4D
SCHEMBL10353459 0.75 CYP1A2 (0.74) CYP1A2PDE4APDE4BPDE4CPDE4D
SCHEMBL7298657 0.74 CYP1A2 (0.50) CYP1A2PDE4APDE4BPDE4CPDE4D
SCHEMBL8888264 0.73 CYP1A2 (0.44) CYP1A2PDE4APDE4BPDE4CPDE4D
SCHEMBL29151059 0.73 XDH (0.59) CYP1A2PDE4APDE4BPDE4CPDE4D

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-0141847-A1 PYRIDAZINONE, PREPARATION PROCESS THEREOF AND UTILISATION THEREOF, DRUGS CONTAINING PYRIDAZINONE Byk Gulden Lomberg Chemische Fabrik GmbH (DE) 1985-05-22 EP disclosed
WO-1984004522-A1 PYRIDAZINONE, PREPARATION PROCESS THEREOF AND UTILISATION THEREOF, DRUGS CONTAINING PYRIDAZINONE BYK GULDEN LOMBERG CHEM FAB (DE) 1984-11-22 WO disclosed