SCHEMBL9414809

SCHEMBL9414809

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

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 2/20 0.35
PDE3A Q14432 2/20 0.35
PDE4A P27815 1/20 0.35
PDE4C Q08493 1/20 0.35
PDE4D Q08499 1/20 0.35
PDE3B Q13370 1/20 0.35
NPC1 O15118 3/20 0.34
RAB9A P51151 3/20 0.34
MTNR1A P48039 3/20 0.33
MTNR1B P49286 3/20 0.33
NPY5R Q15761 1/20 0.33
CA1 P00915 3/20 0.32
CA2 P00918 3/20 0.32
ACHE P22303 3/20 0.32
ALDH1A1 P00352 2/20 0.32
BRAF P15056 3/20 0.32
EGFR P00533 1/20 0.32
RAF1 P04049 1/20 0.32
LCK P06239 1/20 0.32
RET P07949 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
SCHEMBL9414695 0.92 PDE4B (0.35) PDE4BPDE3APDE4APDE4CPDE4D
SCHEMBL8304547 0.78 PDE3B (0.48) PDE4BPDE3APDE4APDE4CPDE4D
SCHEMBL8714966 0.77 MTNR1A (0.33) PDE4BPDE3APDE4APDE4CPDE4D
SCHEMBL8306755 0.76 MTNR1A (0.37) PDE4BPDE3APDE4APDE4CPDE4D
SCHEMBL9414973 0.76 SMN1; SMN2 (0.36) PDE4BPDE3APDE4APDE4CPDE4D
SCHEMBL8305010 0.75 HDAC8 (0.43)
SCHEMBL8717945 0.75 PDE4B (0.33) PDE4BPDE3APDE4APDE4CPDE4D
SCHEMBL9414927 0.75 PNMT (0.40) CA1CA2PKMSMN1; SMN2
SCHEMBL9383997 0.74 NR1H2 (0.35) PDE3APDE3BCA1CA2ALDH1A1
SCHEMBL8718584 0.74 NPC1 (0.41) NPC1RAB9AMTNR1AMTNR1BCA1

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