SCHEMBL10738544

SCHEMBL10738544

O=c1cc2c(n[nH]1)-c1ccc(-n3ccnc3)cc1C2

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ PDE3B Q13370 7/20 1.00
▸ PDE3A Q14432 7/20 1.00
▸ CRBN Q96SW2 3/20 0.51
▸ TBXAS1 P24557 1/20 0.51
▸ PRMT5 O14744 1/20 0.42
▸ WDR77 Q9BQA1 1/20 0.42
▸ PDE2A O00408 1/20 0.41
▸ CYP11B1 P15538 2/20 0.39
▸ CYP11B2 P19099 2/20 0.39
▸ IDO1 P14902 1/20 0.39
▸ CYP19A1 P11511 1/20 0.39
▸ ADH5 P11766 4/20 0.39
▸ FGFR1 P11362 1/20 0.39
▸ FLT1 P17948 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
SCHEMBL7320420 0.84 PDE3A (0.72) PDE3BPDE3ACRBNTBXAS1
SCHEMBL16097172 0.73 PDE3B (0.57) PDE3BPDE3ACRBNTBXAS1CYP11B1
SCHEMBL10341518 0.72 PDE3B (0.55) PDE3BPDE3A
SCHEMBL7290528 0.71 PDE3B (1.00) PDE3BPDE3APDE2AADH5
SCHEMBL28274911 0.71 PDE3B (0.60) PDE3BPDE3ACRBNTBXAS1CYP11B1
SCHEMBL11121491 0.71 PDE3B (0.55) PDE3BPDE3ACRBNTBXAS1CYP11B1
SCHEMBL7273296 0.71 PDE3B (0.60) PDE3BPDE3ACRBNTBXAS1CYP11B1
Hydrochloric Acid SCHEMBL7347426 0.71 PDE3B (0.54) PDE3BPDE3A
SCHEMBL23137976 0.70 PDE3B (0.56) PDE3BPDE3ACRBNTBXAS1PRMT5
SCHEMBL5041825 0.70 MAPK8 (0.53) PDE3BPDE3A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4602019-A Indeno[1,2-c]pyridazin-3-one derivatives useful as cardiotonic and antihypertensive agents WARNER-LAMBERT COMPANY (US) 1986-07-22 — — US claimed
EP-0124314-A2 Substituted-3H-indeno(1,2-c)pyridazin-3-ones WARNER-LAMBERT COMPANY (US) 1984-11-07 — — EP claimed
US-4701453-A Substituted indeno-pyridazinones WARNER-LAMBERT COMPANY (US) 1987-10-20 — — US disclosed
US-4602019-A Indeno[1,2-c]pyridazin-3-one derivatives useful as cardiotonic and antihypertensive agents WARNER-LAMBERT COMPANY (US) 1986-07-22 — — US disclosed
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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