SCHEMBL11121491

SCHEMBL11121491

O=C1CC2=C(NN1)c1ccc(-n3ccnc3)cc1C2

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDE3B Q13370 9/20 0.55
▸ PDE3A Q14432 9/20 0.55
▸ CRBN Q96SW2 3/20 0.51
▸ TBXAS1 P24557 1/20 0.51
▸ PDE4A P27815 2/20 0.40
▸ PDE4B Q07343 2/20 0.40
▸ PDE4C Q08493 2/20 0.40
▸ PDE4D Q08499 2/20 0.40
▸ LMNA P02545 1/20 0.40
▸ CYP1A2 P05177 1/20 0.40
▸ CYP3A4 P08684 1/20 0.40
▸ CYP2D6 P10635 1/20 0.40
▸ CYP2C9 P11712 1/20 0.40
▸ TSHR P16473 1/20 0.40
▸ MAPK1 P28482 1/20 0.40
▸ CYP2C19 P33261 1/20 0.40
▸ CYP11B1 P15538 2/20 0.39
▸ CYP11B2 P19099 2/20 0.39
▸ IDO1 P14902 1/20 0.39
▸ CYP19A1 P11511 1/20 0.39

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
SCHEMBL11032841 0.71 PDE3B (0.51) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL28274911 0.71 PDE3B (0.60) PDE3BPDE3ACRBNTBXAS1LMNA
SCHEMBL10738544 0.71 PDE3B (1.00) PDE3BPDE3ACRBNTBXAS1CYP11B1
SCHEMBL7273296 0.71 PDE3B (0.60) PDE3BPDE3ACRBNTBXAS1PDE4A
SCHEMBL16097172 0.71 PDE3B (0.57) PDE3BPDE3ACRBNTBXAS1LMNA
SCHEMBL23137976 0.70 PDE3B (0.56) PDE3BPDE3ACRBNTBXAS1PDE4A
SCHEMBL27928423 0.68 PDE3B (0.54) PDE3BPDE3ACRBNTBXAS1LMNA
SCHEMBL20777317 0.68 CRBN (1.00) PDE3BPDE3ACRBNTBXAS1PDE4A
SCHEMBL10463333 0.68 PDE3B (1.00) PDE3BPDE3ACRBNTBXAS1PDE4A
SCHEMBL30800784 0.68 CRBN (1.00) PDE3BPDE3ACRBNTBXAS1PDE4A

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-0124314-A2 Substituted-3H-indeno(1,2-c)pyridazin-3-ones WARNER-LAMBERT COMPANY (US) 1984-11-07 — — EP disclosed
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