SCHEMBL9414973

SCHEMBL9414973

NC1CCc2sc(C3=NNC(=O)CC3)cc2C1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.36
PDE3A Q14432 8/20 0.34
PDE3B Q13370 7/20 0.34
ALDH1A1 P00352 2/20 0.34
KDM4E B2RXH2 2/20 0.34
KMT2A Q03164 2/20 0.34
MEN1 O00255 1/20 0.34
NPC1 O15118 1/20 0.34
PKM P14618 1/20 0.34
RAB9A P51151 1/20 0.34
GFER P55789 1/20 0.34
PDE4B Q07343 4/20 0.33
PDE4A P27815 3/20 0.33
PDE4C Q08493 3/20 0.33
PDE4D Q08499 3/20 0.33
MAPT P10636 4/20 0.32
LMNA P02545 1/20 0.32
NPY1R P25929 1/20 0.32
NPY2R P49146 1/20 0.32
NFKB1 P19838 1/20 0.32

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
SCHEMBL9414692 0.90 SMN1; SMN2 (0.36) SMN1; SMN2PDE3APDE3BALDH1A1KDM4E
SCHEMBL9414809 0.76 PDE4B (0.35) SMN1; SMN2PDE3APDE3BALDH1A1KDM4E
SCHEMBL9414927 0.74 PNMT (0.40) SMN1; SMN2PKM
SCHEMBL9414700 0.73 PDE3B (0.50) SMN1; SMN2PDE3APDE3BPDE4BPDE4A
SCHEMBL8305010 0.73 HDAC8 (0.43) MAPTLMNANPY1RNPY2R
Iodide SCHEMBL8309296 0.72 PDE3B (0.49) SMN1; SMN2PDE3APDE3BPDE4BPDE4A
SCHEMBL9414693 0.72 SMN1; SMN2 (0.36) SMN1; SMN2PDE3APDE3BKMT2APDE4B
SCHEMBL9383997 0.71 NR1H2 (0.35) SMN1; SMN2PDE3APDE3BALDH1A1KDM4E
Iodide SCHEMBL8720179 0.71 SMN1; SMN2 (0.35) SMN1; SMN2PDE3APDE3BKMT2APDE4B
SCHEMBL9414771 0.71 MAPT (0.40) SMN1; SMN2PDE3APDE3BALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0579059-A1 Pyridazinone derivatives and processes for preparing the same TANABE SEIYAKU CO., LTD. (JP) 1994-01-19 EP disclosed