SCHEMBL7371211

SCHEMBL7371211

COc1c(O)ccc(CC=NNc2ccc(C3=NNC(=O)CC3C)cc2)c1[N+](=O)[O-]

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDE3B Q13370 14/20 0.47
▸ PDE3A Q14432 14/20 0.47
▸ TNNC1 P63316 1/20 0.47
▸ MAPT P10636 4/20 0.43
▸ SMN1; SMN2 Q16637 2/20 0.43
▸ GALR3 O60755 3/20 0.42
▸ THRB P10828 1/20 0.41
▸ ALDH1A1 P00352 3/20 0.41
▸ MAPK1 P28482 2/20 0.41
▸ LMNA P02545 2/20 0.41
▸ KDM4E B2RXH2 1/20 0.41
▸ CYP1A2 P05177 1/20 0.41
▸ CYP3A4 P08684 1/20 0.41
▸ ALOX15 P16050 1/20 0.41
▸ TSHR P16473 1/20 0.41
▸ BLM P54132 1/20 0.41
▸ NPSR1 Q6W5P4 1/20 0.41
▸ SLFN12 Q8IYM2 1/20 0.40
▸ PDE4A P27815 1/20 0.40
▸ PDE4B Q07343 1/20 0.40

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
SCHEMBL5677201 0.86 PDE3B (0.48) PDE3BPDE3ATNNC1MAPTSMN1; SMN2
SCHEMBL5681007 0.86 PDE3B (0.48) PDE3BPDE3ATNNC1MAPTSMN1; SMN2
SCHEMBL5677182 0.86 PDE3B (0.48) PDE3BPDE3ATNNC1MAPTSMN1; SMN2
SCHEMBL5677191 0.86 PDE3B (0.48) PDE3BPDE3ATNNC1MAPTSMN1; SMN2
SCHEMBL5676841 0.82 PDE3B (0.52) PDE3BPDE3ATNNC1MAPTSMN1; SMN2
SCHEMBL5676837 0.82 PDE3B (0.52) PDE3BPDE3ATNNC1MAPTSMN1; SMN2
SCHEMBL7371494 0.81 PDE3B (0.52) PDE3BPDE3ATNNC1MAPTSMN1; SMN2
SCHEMBL7375687 0.80 PDE3B (0.53) PDE3BPDE3ATNNC1MAPTSMN1; SMN2
SCHEMBL7377597 0.80 PDE3B (0.53) PDE3BPDE3ATNNC1MAPTSMN1; SMN2
SCHEMBL5679128 0.79 PDE3B (0.52) PDE3BPDE3ATNNC1MAPTSMN1; SMN2

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-1265871-A1 PYRIDAZINYL PHENYL HYDRAZONES USEFUL AGAINST CONGESTIVE HEART FAILURE ORION CORPORATION (FI) 2002-12-18 — — EP disclosed
WO-2001068611-A1 PYRIDAZINYL PHENYL HYDRAZONES USEFUL AGAINST CONGESTIVE HEART FAILURE ORION CORPORATION (FI) 2001-09-20 — — WO disclosed
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