SCHEMBL9048858

SCHEMBL9048858

O=C(CC1CCc2c(cccc2C(=O)C(=O)O)C1)NOC(c1ccccc1)c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PTGIR P43119 17/20 0.46
TBXAS1 P24557 2/20 0.41
UGCG Q16739 1/20 0.36

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
SCHEMBL9048134 0.84 PTGIR (0.45) PTGIRUGCG
SCHEMBL9567956 0.84 UGCG (0.48) PTGIRUGCG
SCHEMBL9048745 0.83 PTGIR (0.44) PTGIRTBXAS1
SCHEMBL9048633 0.82 PTGIR (0.38) PTGIR
SCHEMBL9048863 0.82 PTGIR (0.51) PTGIRTBXAS1
SCHEMBL9048866 0.82 PTGIR (0.68) PTGIRTBXAS1
SCHEMBL9048971 0.81 PTGIR (0.37) PTGIRUGCG
SCHEMBL9047720 0.78 PTGIR (0.43) PTGIRUGCG
SCHEMBL9046845 0.77 HPGD (0.47) PTGIR
SCHEMBL9048366 0.76 PTGIR (0.43) 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