SCHEMBL5229527

SCHEMBL5229527

CNC(=O)c1cc(-c2ccc(OC)cc2)n[nH]c1=O

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.59
LMNA P02545 4/20 0.59
ALDH1A1 P00352 2/20 0.59
NPC1 O15118 4/20 0.58
RAB9A P51151 4/20 0.58
ALPL P05186 2/20 0.58
SMN1; SMN2 Q16637 2/20 0.58
GSK3B P49841 3/20 0.57
GSK3A P49840 2/20 0.57
DYRK1A Q13627 2/20 0.57
CA9 Q16790 1/20 0.56
ACR P10323 2/20 0.54
PLK1 P53350 1/20 0.53
JAK2 O60674 1/20 0.53
HDAC3 O15379 2/20 0.52
HDAC4 P56524 2/20 0.52
HDAC1 Q13547 2/20 0.52
HDAC7 Q8WUI4 2/20 0.52
HDAC2 Q92769 2/20 0.52
HDAC10 Q969S8 2/20 0.52

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
SCHEMBL7724864 0.86 MAPT (0.68) MAPTLMNAALDH1A1NPC1RAB9A
SCHEMBL4851311 0.85 ALPL (0.68) MAPTLMNAALDH1A1NPC1RAB9A
SCHEMBL4849100 0.82 MAPT (0.77) MAPTLMNAALDH1A1SMN1; SMN2GSK3B
SCHEMBL5227468 0.81 MAPT (0.60) MAPTLMNAALDH1A1RAB9ASMN1; SMN2
SCHEMBL7724710 0.80 MAPT (0.71) MAPTLMNAALDH1A1NPC1RAB9A
SCHEMBL13987009 0.77 GSK3B (0.54) MAPTLMNAALDH1A1NPC1RAB9A
SCHEMBL13986962 0.77 CYP1A2 (0.55) MAPTALDH1A1GSK3BGSK3ADYRK1A
SCHEMBL14432903 0.76 MEN1 (0.51) MAPTLMNAALDH1A1NPC1RAB9A
SCHEMBL1376033 0.76 GSK3A (0.63) MAPTLMNAALDH1A1NPC1RAB9A
SCHEMBL7723469 0.75 JAK2 (0.52) MAPTLMNAALDH1A1NPC1RAB9A

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-1611121-B1 PYRIDAZINONE DERIVATIVES AS CDK2-INHIBITORS AVENTIS PHARMA SA (FR) 2007-08-08 EP claimed
EP-1581505-B1 PYRIDAZINONE DERIVATIVES AS GSK-3BETA INHIBITORS SANOFI AVENTIS DEUTSCHLAND (DE) 2007-08-01 EP claimed
EP-1611121-B1 PYRIDAZINONE DERIVATIVES AS CDK2-INHIBITORS AVENTIS PHARMA SA (FR) 2007-08-08 EP disclosed
EP-1581505-B1 PYRIDAZINONE DERIVATIVES AS GSK-3BETA INHIBITORS SANOFI AVENTIS DEUTSCHLAND (DE) 2007-08-01 EP disclosed
US-6403586-B1 Pyridazine derivatives and drugs containing the same as the active ingredient KOWA CO., LTD. (JP) 2002-06-11 US disclosed
EP-1061077-A1 NOVEL PYRIDAZINE DERIVATIVES AND DRUGS CONTAINING THE SAME AS THE ACTIVE INGREDIENT Kowa Co., Ltd. (JP) 2000-12-20 EP disclosed