SCHEMBL6259201

SCHEMBL6259201

COc1ccc(-c2nn(CC(C)C)c(=O)c(C(N)=O)c2-c2ccc(OC)cc2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.43
ALDH1A1 P00352 2/20 0.43
HPGD P15428 1/20 0.43
TP53 P04637 3/20 0.41
PSMB1 P20618 1/20 0.40
PSMB5 P28074 1/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
SRC P12931 2/20 0.39
NTRK1 P04629 1/20 0.39
PIM1 P11309 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
POLB P06746 1/20 0.39
GAA P10253 1/20 0.39
FGFR1 P11362 1/20 0.39
FGFR2 P21802 1/20 0.39
FGFR4 P22455 1/20 0.39
FGFR3 P22607 1/20 0.39
CCNE2 O96020 1/20 0.39
CDK4 P11802 1/20 0.39

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
SCHEMBL6256484 0.90 KDM4E (0.43) KDM4EALDH1A1HPGDTP53PSMB1
SCHEMBL6260962 0.87 TP53 (0.53) KDM4EALDH1A1HPGDTP53SMN1; SMN2
SCHEMBL6254981 0.87 KDM4E (0.48) KDM4EALDH1A1HPGDTP53PSMB1
SCHEMBL6254976 0.87 KDM4E (0.41) KDM4EALDH1A1HPGDTP53PSMB1
SCHEMBL7730189 0.86 MEN1 (0.44) KDM4EALDH1A1HPGDPSMB1PSMB5
SCHEMBL6257629 0.86 POLB (0.56) KDM4EALDH1A1HPGDTP53SMN1; SMN2
SCHEMBL6257620 0.85 TP53 (0.44) KDM4EALDH1A1HPGDTP53SMN1; SMN2
SCHEMBL6257619 0.83 TP53 (0.43) KDM4EALDH1A1HPGDTP53SMN1; SMN2
SCHEMBL6255329 0.82 SRC (0.48) ALDH1A1TP53SMN1; SMN2SRCNTRK1
SCHEMBL6258095 0.82 AURKA (0.49) KDM4ETP53SMN1; SMN2LMNA

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 3 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 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