SCHEMBL6257634

SCHEMBL6257634

CCOC(=O)c1c(-c2ccc(OC)cc2)c(-c2ccc(OC)cc2)nn(Cc2ccccc2)c1=O

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.59
PDE4A P27815 2/20 0.56
PDE4B Q07343 2/20 0.56
PDE4C Q08493 2/20 0.56
PDE4D Q08499 2/20 0.56
TP53 P04637 5/20 0.55
SMN1; SMN2 Q16637 4/20 0.55
F2RL3 Q96RI0 1/20 0.53
POLB P06746 2/20 0.51
GAA P10253 1/20 0.51
CYP1A2 P05177 1/20 0.50
CYP3A4 P08684 1/20 0.50
CYP2D6 P10635 1/20 0.50
CYP2C9 P11712 1/20 0.50
CYP2C19 P33261 1/20 0.50
MAPK1 P28482 1/20 0.50
ALDH1A1 P00352 3/20 0.49
KDM4E B2RXH2 2/20 0.49
HPGD P15428 2/20 0.49
RECQL P46063 1/20 0.49

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
SCHEMBL6258294 0.88 EDNRB (0.53) MAPTPDE4APDE4BPDE4CPDE4D
SCHEMBL6256500 0.86 CYP1A2 (0.53) MAPTPDE4APDE4BPDE4CPDE4D
SCHEMBL6259734 0.86 CYP1A2 (0.47) MAPTPDE4APDE4BPDE4CPDE4D
SCHEMBL6256619 0.84 CYP1A2 (0.48) MAPTPDE4APDE4BPDE4CPDE4D
SCHEMBL6261363 0.84 ALDH1A1 (0.52) MAPTPDE4APDE4BPDE4CPDE4D
SCHEMBL6257629 0.83 POLB (0.56) MAPTPDE4DTP53SMN1; SMN2POLB
SCHEMBL6254804 0.82 POLB (0.51) MAPTPDE4APDE4BPDE4CPDE4D
SCHEMBL3851363 0.81 PDE4A (0.61) MAPTPDE4APDE4BPDE4CPDE4D
SCHEMBL6256516 0.79 POLB (0.55) MAPTPDE4DTP53SMN1; SMN2POLB
SCHEMBL3846803 0.79 MAPT (0.46) MAPTPDE4APDE4BPDE4CPDE4D

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1156039-B1 PYRIDAZIN-3-ONE DERIVATIVES AND MEDICINES CONTAINING THE SAME KOWA CO (JP) 2005-10-05 EP claimed
US-6680316-B1 INTERLEUKIN INHIBITORS; AUTOIMMUNE, RHEUMATIC, AND GASTROINTESTINAL DISORDERS; OSTEOPOROSIS; ANTIINFLAMMATORY, ANTIISCHEMIC, AND ANTIARTHRITIC AGENTS KOWA CO., LTD. (JP) 2004-01-20 US claimed
EP-1156039-A1 PYRIDAZIN-3-ONE DERIVATIVES AND MEDICINES CONTAINING THE SAME Kowa Co., Ltd. (JP) 2001-11-21 EP claimed
EP-1156039-B1 PYRIDAZIN-3-ONE DERIVATIVES AND MEDICINES CONTAINING THE SAME KOWA CO (JP) 2005-10-05 EP disclosed
US-6680316-B1 INTERLEUKIN INHIBITORS; AUTOIMMUNE, RHEUMATIC, AND GASTROINTESTINAL DISORDERS; OSTEOPOROSIS; ANTIINFLAMMATORY, ANTIISCHEMIC, AND ANTIARTHRITIC AGENTS KOWA CO., LTD. (JP) 2004-01-20 US disclosed
EP-1156039-A1 PYRIDAZIN-3-ONE DERIVATIVES AND MEDICINES CONTAINING THE SAME Kowa Co., Ltd. (JP) 2001-11-21 EP disclosed