SCHEMBL7347151

SCHEMBL7347151

CC1=C(c2ccc(-n3ccnc3C)cc2)CC(=O)N1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDE3B Q13370 3/20 0.56
▸ PDE3A Q14432 3/20 0.56
▸ MGAM O43451 1/20 0.50
▸ GAA P10253 1/20 0.50
▸ SI P14410 1/20 0.50
▸ MGAM2 Q2M2H8 1/20 0.50
▸ ALDH1A1 P00352 1/20 0.48
▸ ADH5 P11766 3/20 0.47
▸ PDE4B Q07343 6/20 0.43
▸ PDE4A P27815 5/20 0.43
▸ PDE4C Q08493 5/20 0.43
▸ PDE4D Q08499 5/20 0.43
▸ CYP3A4 P08684 3/20 0.42
▸ CYP2D6 P10635 2/20 0.42
▸ CYP1A2 P05177 1/20 0.42
▸ CYP19A1 P11511 1/20 0.42
▸ CYP2C9 P11712 1/20 0.42
▸ CYP2C19 P33261 1/20 0.42
▸ CYP2E1 P05181 1/20 0.40
▸ CYP2A6 P11509 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
SCHEMBL10755622 0.88 PDE3B (0.62) PDE3BPDE3AMGAMGAASI
Hydrochloric Acid SCHEMBL10759777 0.87 PDE3B (0.60) PDE3BPDE3AMGAMGAASI
SCHEMBL7340182 0.85 PDE3B (0.52) PDE3BPDE3AMGAMGAASI
SCHEMBL7340318 0.80 PDE3B (0.40) PDE3BPDE3AMGAMGAASI
SCHEMBL10759148 0.80 PDE3B (0.49) PDE3BPDE3AMGAMGAASI
Hydrochloric Acid SCHEMBL10761022 0.79 PDE3B (0.48) PDE3BPDE3AMGAMGAASI
SCHEMBL10757838 0.77 PDE3B (0.52) PDE3BPDE3AMGAMGAASI
SCHEMBL7341161 0.77 PDE3B (0.54) PDE3BPDE3AMGAMGAASI
SCHEMBL10759143 0.76 PDE3B (0.57) PDE3BPDE3AMGAMGAASI
SCHEMBL7341034 0.76 PDE3B (0.62) PDE3BPDE3AADH5PDE4BPDE4A

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-0329691-B1 CARDIOTONIC IMIDAZOLYLPHENYLPYRROL-2-ONES SCHERING AKTIENGESELLSCHAFT (DE) 1991-11-21 — — EP claimed
EP-0329691-A1 CARDIOTONIC IMIDAZOLYLPHENYLPYRROL-2-ONES. SCHERING AG (DE) 1989-08-30 — — EP claimed
WO-1988003531-A1 CARDIOTONIC IMIDAZOLYLPHENYLPYRROL-2-ONES SCHERING AKTIENGESELLSCHAFT (DE) 1988-05-19 — — WO claimed
US-4737511-A Cardiotonic imidazolylphenylpyrrol-2-ones SCHERING A.G. (DE) 1988-04-12 — — US claimed
EP-0329691-B1 CARDIOTONIC IMIDAZOLYLPHENYLPYRROL-2-ONES SCHERING AKTIENGESELLSCHAFT (DE) 1991-11-21 — — EP disclosed
EP-0329691-A1 CARDIOTONIC IMIDAZOLYLPHENYLPYRROL-2-ONES. SCHERING AG (DE) 1989-08-30 — — EP disclosed
WO-1988003531-A1 CARDIOTONIC IMIDAZOLYLPHENYLPYRROL-2-ONES SCHERING AKTIENGESELLSCHAFT (DE) 1988-05-19 — — WO disclosed
US-4737511-A Cardiotonic imidazolylphenylpyrrol-2-ones SCHERING A.G. (DE) 1988-04-12 — — US disclosed
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