SCHEMBL7269190

SCHEMBL7269190

CC1CC(=O)NN=C1c1ccc(N2CCC(NC(=N)NCCCc3c[nH]cn3)CC2)c([N+](=O)[O-])c1

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.46
GALR3 O60755 3/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
PDE3B Q13370 10/20 0.45
PDE3A Q14432 10/20 0.45
ALDH1A1 P00352 2/20 0.45
SLFN12 Q8IYM2 1/20 0.45
LMNA P02545 1/20 0.45
MAPK1 P28482 1/20 0.45
GAA P10253 1/20 0.44
THRB P10828 1/20 0.44
PDE4A P27815 1/20 0.38
PDE4B Q07343 1/20 0.38
PDE4C Q08493 1/20 0.38
PDE4D Q08499 1/20 0.38
HRH3 Q9Y5N1 3/20 0.35
GPR119 Q8TDV5 1/20 0.34
POLB P06746 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
SCHEMBL7267790 0.90 MAPT (0.47) MAPTGALR3SMN1; SMN2PDE3BPDE3A
SCHEMBL10429892 0.89 MAPT (0.34) MAPTGALR3SMN1; SMN2PDE3BPDE3A
SCHEMBL7273730 0.87 MAPT (0.42) MAPTGALR3SMN1; SMN2PDE3BPDE3A
SCHEMBL7274069 0.86 MAPT (0.49) MAPTGALR3SMN1; SMN2PDE3BPDE3A
SCHEMBL7292146 0.86 MAPT (0.47) MAPTGALR3SMN1; SMN2PDE3BPDE3A
SCHEMBL7267466 0.83 MAPT (0.62) MAPTGALR3SMN1; SMN2PDE3BPDE3A
SCHEMBL7275977 0.83 MAPT (0.62) MAPTGALR3SMN1; SMN2PDE3BPDE3A
SCHEMBL7292139 0.83 MAPT (0.46) MAPTGALR3SMN1; SMN2PDE3BPDE3A
SCHEMBL7298909 0.80 MAPT (0.45) MAPTGALR3SMN1; SMN2PDE3BPDE3A
SCHEMBL10482920 0.80 MAPT (0.47) MAPTGALR3SMN1; SMN2PDE3BPDE3A

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-0339208-A1 6-Oxopyridazine derivatives, process for their preparation and medicaments containing these compounds HEUMANN PHARMA GMBH & CO (DE) 1989-11-02 EP disclosed