SCHEMBL11118428

SCHEMBL11118428

Nc1cc(C=O)ccc1C1=NNC(=O)CC1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.43
PDE3A Q14432 11/20 0.39
PDE3B Q13370 10/20 0.39
PDE4B Q07343 8/20 0.39
PDE4A P27815 7/20 0.39
PDE4C Q08493 7/20 0.39
PDE4D Q08499 7/20 0.39
KCNH2 Q12809 1/20 0.36
LMNA P02545 4/20 0.35
RAB9A P51151 2/20 0.35
KDM4E B2RXH2 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
PTGS1 P23219 1/20 0.35
PTGS2 P35354 1/20 0.35
NPY1R P25929 1/20 0.35
NPY2R P49146 1/20 0.35
MAPT P10636 1/20 0.35
CYP1A2 P05177 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2D6 P10635 1/20 0.34

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
SCHEMBL7296033 0.76 MAPT (0.45) SMN1; SMN2PDE3APDE3BPDE4BPDE4A
SCHEMBL7983325 0.75 SMN1; SMN2 (0.64) SMN1; SMN2PDE3APDE3BPDE4BPDE4A
SCHEMBL2986344 0.75 KCNH2 (0.52) SMN1; SMN2PDE3APDE3BPDE4BPDE4A
SCHEMBL11371397 0.72 SMN1; SMN2 (0.38) SMN1; SMN2PDE3APDE3BPDE4BPDE4A
SCHEMBL7284601 0.72 SMN1; SMN2 (0.46) SMN1; SMN2PDE3APDE3BPDE4BPDE4A
SCHEMBL2986346 0.71 SMN1; SMN2 (0.47) SMN1; SMN2PDE3APDE3BPDE4BPDE4A
SCHEMBL11370899 0.70 PTGER4 (0.44) SMN1; SMN2LMNARAB9AKDM4EL3MBTL1
SCHEMBL7300917 0.69 POLB (0.48) SMN1; SMN2PDE3APDE3BPDE4BPDE4A
SCHEMBL9184755 0.68 PDE3B (0.57) SMN1; SMN2PDE3APDE3BPDE4BPDE4A
SCHEMBL11571230 0.67 SMN1; SMN2 (0.47) SMN1; SMN2PDE3APDE3BPDE4BPDE4A

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-0116853-A1 Pyridazinones, processes for preparing them, therapeutical compositions containing these compounds and their use BASF Aktiengesellschaft (DE) 1984-08-29 EP disclosed