SCHEMBL7298909

SCHEMBL7298909

CC1CC(=O)NN=C1c1ccc(N2CCN(CCCNC(N)=NCCCc3c[nH]cn3)CC2)c([N+](=O)[O-])c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.45
GALR3 O60755 3/20 0.45
THRB P10828 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.44
PDE3B Q13370 9/20 0.41
PDE3A Q14432 9/20 0.41
ALDH1A1 P00352 4/20 0.41
SLFN12 Q8IYM2 1/20 0.41
LMNA P02545 1/20 0.41
MAPK1 P28482 1/20 0.41
GAA P10253 2/20 0.41
HRH3 Q9Y5N1 2/20 0.38
PDE4A P27815 1/20 0.34
PDE4B Q07343 1/20 0.34
PDE4C Q08493 1/20 0.34
PDE4D Q08499 1/20 0.34
GPR119 Q8TDV5 1/20 0.33
ADRA1D P25100 1/20 0.33
ADRA1A P35348 1/20 0.33
ADRA1B P35368 1/20 0.33

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 0.89 MAPT (0.47) MAPTGALR3THRBSMN1; SMN2PDE3B
SCHEMBL7292146 0.88 MAPT (0.47) MAPTGALR3THRBSMN1; SMN2PDE3B
SCHEMBL7294730 0.86 MAPT (0.58) MAPTGALR3THRBSMN1; SMN2PDE3B
SCHEMBL7292075 0.86 MAPT (0.58) MAPTGALR3THRBSMN1; SMN2PDE3B
SCHEMBL7290316 0.85 MAPT (0.59) MAPTGALR3THRBSMN1; SMN2PDE3B
SCHEMBL7274069 0.84 MAPT (0.49) MAPTGALR3THRBSMN1; SMN2PDE3B
SCHEMBL7290853 0.84 MAPT (0.45) MAPTGALR3THRBSMN1; SMN2PDE3B
SCHEMBL7269190 0.80 MAPT (0.46) MAPTGALR3THRBSMN1; SMN2PDE3B
SCHEMBL10474289 0.79 GALR3 (0.53) MAPTGALR3THRBSMN1; SMN2PDE3B
SCHEMBL7292139 0.78 MAPT (0.46) MAPTGALR3THRBSMN1; SMN2PDE3B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0339208-B1 6-Oxopyridazine derivatives, process for their preparation and medicaments containing these compounds HEUMANN PHARMA GMBH & CO (DE) 1996-02-07 EP claimed
EP-0339208-B1 6-Oxopyridazine derivatives, process for their preparation and medicaments containing these compounds HEUMANN PHARMA GMBH & CO (DE) 1996-02-07 EP disclosed