SCHEMBL8307154

SCHEMBL8307154

CCCCS(=O)(=O)NC1CCc2cc(-c3ccc(=O)[nH]n3)ccc2C1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC8 Q9BY41 1/20 0.52
MAPT P10636 1/20 0.42
PSEN1 P49768 1/20 0.41
PSEN2 P49810 1/20 0.41
APH1B Q8WW43 1/20 0.41
NCSTN Q92542 1/20 0.41
APH1A Q96BI3 1/20 0.41
PSENEN Q9NZ42 1/20 0.41
PDE3B Q13370 1/20 0.40
PDE3A Q14432 1/20 0.40
CA1 P00915 3/20 0.38
CA2 P00918 3/20 0.38
ACHE P22303 2/20 0.38
GRIA2 P42262 5/20 0.37
PDE4A P27815 1/20 0.37
PDE4B Q07343 1/20 0.37
PDE4C Q08493 1/20 0.37
PDE4D Q08499 1/20 0.37
LMNA P02545 2/20 0.36
MEN1 O00255 1/20 0.36

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
SCHEMBL8302585 0.92 MAPT (0.46) HDAC8MAPTPSEN1PSEN2APH1B
SCHEMBL8307491 0.86 GRIA2 (0.45) MAPTPSEN1PSEN2APH1BNCSTN
SCHEMBL8302569 0.80 MAPT (0.42) HDAC8MAPTPDE3BPDE3AGRIA2
SCHEMBL8307326 0.80 HDAC8 (0.51) HDAC8MAPTPSEN1PSEN2APH1B
SCHEMBL8718589 0.79 GRIA2 (0.43) PDE3BPDE3AGRIA2PDE4APDE4B
SCHEMBL9414967 0.78 HDAC8 (0.45) HDAC8MAPTPSEN1PSEN2APH1B
Hydrochloric Acid SCHEMBL8719903 0.77 HDAC8 (0.45) HDAC8MAPTPSEN1PSEN2APH1B
SCHEMBL8715566 0.76 MAPT (0.44) MAPTPDE3BPDE3AGRIA2PDE4A
SCHEMBL8302588 0.76 PDE3B (0.44) MAPTPDE3BPDE3AGRIA2PDE4A
SCHEMBL8300364 0.75 TBXA2R (0.45) MAPTPSEN1PSEN2APH1BNCSTN

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-0579059-B1 Pyridazinone derivatives and processes for preparing the same TANABE SEIYAKU CO (JP) 1999-05-12 EP disclosed
US-5739132-A ENDOTHOXIN SHOCK; NEPHRITIS TANABE SEIYAKU CO., LTD. (JP) 1998-04-14 US disclosed
EP-0579059-A1 Pyridazinone derivatives and processes for preparing the same TANABE SEIYAKU CO., LTD. (JP) 1994-01-19 EP disclosed