SCHEMBL9048866

SCHEMBL9048866

O=C(O)COc1cccc2c1CCC(CC(=O)NOC(c1ccccc1)c1ccccc1)C2

nearest known ligand 0.68

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PTGIR P43119 18/20 0.68
TBXAS1 P24557 2/20 0.59

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
SCHEMBL9048863 0.86 PTGIR (0.51) PTGIRTBXAS1
SCHEMBL9048143 0.86 PTGIR (0.70) PTGIRTBXAS1
SCHEMBL9048750 0.85 PTGIR (0.69) PTGIRTBXAS1
SCHEMBL9005607 0.84 PTGIR (0.74) PTGIRTBXAS1
SCHEMBL9048642 0.84 PTGIR (0.62) PTGIRTBXAS1
SCHEMBL9046527 0.83 PTGIR (0.67) PTGIRTBXAS1
SCHEMBL9048983 0.82 PTGIR (0.57) PTGIRTBXAS1
SCHEMBL9048858 0.82 PTGIR (0.46) PTGIRTBXAS1
SCHEMBL9567956 0.82 UGCG (0.48) PTGIR
SCHEMBL9427446 0.81 PTGIR (1.00) PTGIR

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-0542203-B1 Fused benzeneoxyacetic acid derivatives as PGl2 receptor agonists ONO PHARMACEUTICAL CO (JP) 1996-07-03 EP claimed
US-5344836-A Fused benzeneoxyacetic acid derivatives ONO PHARMACEUTICAL CO., LTD. (JP) 1994-09-06 US claimed