SCHEMBL6609099

SCHEMBL6609099

C(=C/N1CCc2c([nH]c3ccccc23)C1c1ccc2c(c1)OCO2)\Cc1ccc(-n2ccnc2)cc1

nearest known ligand 0.60

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PDE5A O76074 17/20 0.47

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
SCHEMBL7492514 0.87 PDE5A (0.55) PDE5A
SCHEMBL7079147 0.85 PDE5A (0.53) PDE5A
SCHEMBL4535697 0.82 PDE5A (0.53) PDE5A
SCHEMBL6615462 0.81 PDE5A (0.54) PDE5A
SCHEMBL7149186 0.81 PDE5A (0.54) PDE5A
SCHEMBL1327213 0.78 PDE5A (0.60) PDE5A
SCHEMBL6609839 0.78 PDE5A (0.56) PDE5A
SCHEMBL7154977 0.77 PDE5A (0.52) PDE5A
SCHEMBL6412972 0.75 PDE5A (0.70) PDE5A
SCHEMBL7154398 0.74 PDE5A (0.61) PDE5A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1458679-A2 PYRROLIDINE DERIVATIVES AS PROSTAGLANDIN MODULATORS Applied Research Systems ARS Holding N.V. (AN) 2004-09-22 EP disclosed
WO-2003053923-A2 PYRROLIDINE DERIVATIVES AS PROSTAGLANDIN MODULATORS APPLIED RESEARCH SYSTEMS ARS HOLDING N.V. (AN) 2003-07-03 WO disclosed