SCHEMBL7280452

SCHEMBL7280452

O=c1ccc(-c2ccc(-n3cnc(CO)c3)cc2)n[nH]1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDE3B Q13370 5/20 0.56
▸ PDE3A Q14432 5/20 0.56
▸ LMNA P02545 2/20 0.47
▸ MEN1 O00255 1/20 0.47
▸ KMT2A Q03164 1/20 0.47
▸ CYP1A2 P05177 1/20 0.45
▸ MAPT P10636 1/20 0.42
▸ HRH3 Q9Y5N1 9/20 0.42
▸ PDE4A P27815 1/20 0.38
▸ PDE4B Q07343 1/20 0.38
▸ PDE4C Q08493 1/20 0.38
▸ PDE4D Q08499 1/20 0.38
▸ KCNH2 Q12809 2/20 0.37
▸ CHRM2 P08172 1/20 0.37
▸ SLC6A2 P23975 1/20 0.37
▸ ADRA1A P35348 1/20 0.37
▸ HTR3A P46098 1/20 0.37
▸ SLC6A3 Q01959 1/20 0.37
▸ MAP4K4 O95819 1/20 0.37
▸ PDE2A O00408 1/20 0.36

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
SCHEMBL7277959 0.77 PDE3B (0.68) PDE3BPDE3ALMNAMEN1KMT2A
SCHEMBL3098258 0.77 PDE3B (0.50) PDE3BPDE3AHRH3KCNH2MAP4K4
SCHEMBL7287382 0.74 PDE3B (0.59) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL4427934 0.74 PDE3B (0.54) PDE3BPDE3AMEN1KMT2AMAPT
SCHEMBL7279874 0.74 PDE3A (0.68) PDE3BPDE3ALMNAMEN1KMT2A
SCHEMBL7319085 0.73 PDE3B (0.67) PDE3BPDE3ALMNAMEN1KMT2A
SCHEMBL3452908 0.72 LMNA (0.80) PDE3BPDE3ALMNAMEN1KMT2A
SCHEMBL7280366 0.72 PDE3B (1.00) PDE3BPDE3ALMNAMEN1KMT2A
SCHEMBL7277863 0.71 PDE3B (1.00) PDE3BPDE3ALMNAKMT2ACYP1A2
SCHEMBL2173293 0.70 PDE3B (0.50) PDE3BPDE3ACYP1A2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4734415-A CARDIOTONIC, HYPOTENSIVE WARNER-LAMBERT COMPANY (US) 1988-03-29 — — US claimed
EP-0075436-A1 Substituted 4,5-dihydro-6-(substituted)-phenyl-3(2H)-pyridazinones and 6-(substituted)phenyl-3(2H)-pyridazinones WARNER-LAMBERT COMPANY (US) 1983-03-30 — — EP claimed
US-4734415-A CARDIOTONIC, HYPOTENSIVE WARNER-LAMBERT COMPANY (US) 1988-03-29 — — US disclosed
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