SCHEMBL6257620

SCHEMBL6257620

CCCn1nc(-c2ccc(OC)cc2)c(-c2ccc(OC)cc2)c(C(N)=O)c1=O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 3/20 0.44
KDM4E B2RXH2 2/20 0.43
ALDH1A1 P00352 2/20 0.43
HPGD P15428 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
THRB P10828 1/20 0.42
RXFP1 Q9HBX9 1/20 0.42
LMNA P02545 1/20 0.41
NTRK1 P04629 1/20 0.40
PIM1 P11309 1/20 0.40
POLB P06746 1/20 0.40
GAA P10253 1/20 0.40
CCNE2 O96020 1/20 0.40
CDK4 P11802 1/20 0.40
CCND1 P24385 1/20 0.40
CCNE1 P24864 1/20 0.40
CDK2 P24941 1/20 0.40
TGM2 P21980 1/20 0.39
TGM1 P22735 1/20 0.39
CASP3 P42574 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
SCHEMBL6257619 0.93 TP53 (0.43) TP53KDM4EALDH1A1HPGDSMN1; SMN2
SCHEMBL6260962 0.91 TP53 (0.53) TP53KDM4EALDH1A1HPGDSMN1; SMN2
SCHEMBL6259201 0.85 KDM4E (0.43) TP53KDM4EALDH1A1HPGDSMN1; SMN2
SCHEMBL6254733 0.83 PTGIR (0.50) TP53KDM4EALDH1A1HPGDBTK
SCHEMBL6256500 0.83 CYP1A2 (0.53) TP53KDM4EALDH1A1HPGDSMN1; SMN2
SCHEMBL6255253 0.81 PTGIR (0.46) TP53KDM4EALDH1A1HPGDPOLB
SCHEMBL6276770 0.81 PTGIR (0.46) TP53KDM4EALDH1A1HPGDPOLB
SCHEMBL6255329 0.79 SRC (0.48) TP53ALDH1A1SMN1; SMN2LMNANTRK1
SCHEMBL6254289 0.78 GRIA2 (0.46) KDM4EALDH1A1HPGDSMN1; SMN2RXFP1
SCHEMBL6256484 0.74 KDM4E (0.43) TP53KDM4EALDH1A1HPGDSMN1; SMN2

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