SCHEMBL5540522

SCHEMBL5540522

O=c1c2c([nH]c3ccccc13)CNC2c1ccc2c(c1)CCO2

nearest known ligand 0.51

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ PDE5A O76074 8/20 0.51

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
SCHEMBL2509857 0.83 PDE5A (0.60) PDE5A
SCHEMBL2502972 0.83 PDE5A (0.60) PDE5A
Hydrochloric Acid SCHEMBL6407788 0.82 PDE5A (0.59) PDE5A
Hydrochloric Acid SCHEMBL5537994 0.82 PDE5A (0.59) PDE5A
SCHEMBL14599794 0.74 PDE5A (0.60) PDE5A
SCHEMBL5532312 0.72 HTR7 (0.61) PDE5A
SCHEMBL14599797 0.72 HTR7 (0.61) PDE5A
SCHEMBL2504528 0.72 HTR7 (0.61) PDE5A
SCHEMBL5528826 0.72 HTR7 (0.61) PDE5A
SCHEMBL14599799 0.71 PDE5A (0.72) 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-1851227-A1 AN EFFICIENT AND STEREOSELECTIVE PROCESS FOR LARGE SCALE SYNTHESIS OF 3-(R)-3- (2,3-DIHYDROBENZOFURAN-5-YL)-1,2,3,4- TETRAHYDROPYRROLO{3,4-B}QUINOLIN-9-ONE JANSSEN PHARMACEUTICA N.V. (BE) 2007-11-07 — — EP disclosed
WO-2006093719-A1 AN EFFICIENT AND STEREOSELECTIVE PROCESS FOR LARGE SCALE SYNTHESIS OF 3-(R)-3- (2,3-DIHYDROBENZOFURAN-5-YL)-1,2,3,4- TETRAHYDROPYRROLO{3,4-B}QUINOLIN-9-ONE JANSSEN PHARMACEUTICA, N.V. (BE) 2006-09-08 — — WO disclosed
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