SCHEMBL7427396

SCHEMBL7427396

Cc1[nH]c(=O)oc1C(=O)c1ccc(-n2ccnc2)cc1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDE4A P27815 3/20 0.65
▸ PDE4B Q07343 3/20 0.65
▸ PDE4C Q08493 3/20 0.65
▸ PDE4D Q08499 3/20 0.65
▸ CYP3A4 P08684 1/20 0.55
▸ BAZ2B Q9UIF8 1/20 0.55
▸ HTT P42858 1/20 0.51
▸ ADH5 P11766 4/20 0.49
▸ HTR2A P28223 1/20 0.47
▸ HTR2C P28335 1/20 0.47
▸ HTR2B P41595 1/20 0.47
▸ MAOB P27338 1/20 0.46
▸ TDP1 Q9NUW8 1/20 0.45
▸ MAPT P10636 3/20 0.44
▸ PKM P14618 1/20 0.44
▸ LMNA P02545 1/20 0.44
▸ ENPP2 Q13822 1/20 0.43
▸ MKNK1 Q9BUB5 1/20 0.43
▸ MKNK2 Q9HBH9 1/20 0.43
▸ PDE2A O00408 1/20 0.43

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
SCHEMBL7425680 0.80 PDE3B (0.43) PDE4APDE4BPDE4CPDE4DCYP3A4
SCHEMBL7338886 0.79 PDE4A (1.00) PDE4APDE4BPDE4CPDE4DCYP3A4
SCHEMBL10574724 0.78 CYP3A4 (0.74) PDE4APDE4BPDE4CPDE4DCYP3A4
Hydrochloric Acid SCHEMBL7341944 0.78 PDE4A (0.97) PDE4APDE4BPDE4CPDE4DCYP3A4
SCHEMBL15759856 0.73 CYP3A4 (0.63) PDE4APDE4BPDE4CPDE4DCYP3A4
SCHEMBL608826 0.72 ADH5 (0.67) PDE4APDE4BPDE4CPDE4DCYP3A4
SCHEMBL611481 0.72 CYP3A4 (1.00) PDE4APDE4BPDE4CPDE4DCYP3A4
SCHEMBL5307055 0.71 MAOB (0.67) PDE4APDE4BPDE4CPDE4DCYP3A4
SCHEMBL6324509 0.71 MAPT (0.74) PDE4APDE4BPDE4CPDE4DCYP3A4
SCHEMBL7266072 0.71 PDE4A (1.00) PDE4APDE4BPDE4CPDE4DCYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0329070-B1 Cardiotonic alkanoyl and aroyl oxazolones MERRELL DOW PHARMA (US) 1994-01-05 — — EP claimed
US-4866182-A TREATMENT OF HEART FAILURE MERRELL DOW PHARMACEUTICALS INC. (US) 1989-09-12 — — US claimed
EP-0329070-A1 Cardiotonic alkanoyl and aroyl oxazolones MERRELL DOW PHARMACEUTICALS INC. (US) 1989-08-23 — — EP claimed
JP-2149571-A — — None — — JP disclosed
EP-0329070-B1 Cardiotonic alkanoyl and aroyl oxazolones MERRELL DOW PHARMA (US) 1994-01-05 — — EP disclosed
JP-H02149571-A CARDIOTONIC ALKANOYL AND AROYL OXAZOLONE MERRELL DOW PHARMACEUT INC 1990-06-08 — — JP disclosed
US-4866182-A TREATMENT OF HEART FAILURE MERRELL DOW PHARMACEUTICALS INC. (US) 1989-09-12 — — US disclosed
EP-0329070-A1 Cardiotonic alkanoyl and aroyl oxazolones MERRELL DOW PHARMACEUTICALS INC. (US) 1989-08-23 — — EP disclosed
Send feedback