SCHEMBL7431010

SCHEMBL7431010

CCc1nc2c(n1Cc1ccccc1)C(=O)N(C)C1=NC3CCCC3N12

nearest known ligand 0.87

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ PDE5A O76074 20/20 0.87
▸ PDE4A P27815 1/20 0.79
▸ PDE4B Q07343 1/20 0.79
▸ PDE4C Q08493 1/20 0.79
▸ PDE4D Q08499 1/20 0.79

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
SCHEMBL237558 1.00 PDE5A (0.87) PDE5APDE4APDE4BPDE4CPDE4D
SCHEMBL237559 1.00 PDE5A (0.87) PDE5APDE4APDE4BPDE4CPDE4D
SCHEMBL7443433 0.98 PDE5A (0.83) PDE5APDE4APDE4BPDE4CPDE4D
SCHEMBL7443441 0.98 PDE5A (0.83) PDE5APDE4APDE4BPDE4CPDE4D
SCHEMBL194835 0.98 PDE5A (0.83) PDE5APDE4APDE4BPDE4CPDE4D
SCHEMBL253643 0.93 PDE5A (1.00) PDE5APDE4APDE4BPDE4CPDE4D
SCHEMBL231701 0.93 PDE5A (1.00) PDE5APDE4APDE4BPDE4CPDE4D
SCHEMBL714981 0.91 PDE5A (0.85) PDE5APDE4APDE4BPDE4CPDE4D
SCHEMBL714980 0.91 PDE5A (0.85) PDE5APDE4APDE4BPDE4CPDE4D
SCHEMBL714979 0.91 PDE5A (0.85) PDE5APDE4APDE4BPDE4CPDE4D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0538332-B1 POLYCYCLIC GUANINE DERIVATIVES SCHERING CORP (US) 1997-07-23 — — EP claimed
WO-1991019717-A1 POLYCYCLIC GUANINE DERIVATIVES SCHERING CORPORATION (US) 1991-12-26 — — WO claimed
EP-0538332-B1 POLYCYCLIC GUANINE DERIVATIVES SCHERING CORP (US) 1997-07-23 — — EP disclosed
US-5393755-A Hypotensive agents, enzyme inhibitors SCHERING CORPORATION (US) 1995-02-28 — — US disclosed
EP-0538332-A1 POLYCYCLIC GUANINE DERIVATIVES. SCHERING CORP (US) 1993-04-28 — — EP disclosed
WO-1991019717-A1 POLYCYCLIC GUANINE DERIVATIVES SCHERING CORPORATION (US) 1991-12-26 — — WO disclosed
Send feedback