SCHEMBL8858396

SCHEMBL8858396

CN(CCC1CCc2c(cccc2OCC(=O)O)C1)C(=S)NC(c1ccccc1)c1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PTGIR P43119 19/20 0.61
TBXAS1 P24557 1/20 0.48
PTGDR Q13258 1/20 0.46

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
SCHEMBL8858458 0.91 PTGIR (0.58) PTGIRTBXAS1PTGDR
SCHEMBL8858445 0.91 PTGIR (0.62) PTGIRTBXAS1
SCHEMBL9046372 0.88 PTGIR (0.45) PTGIRTBXAS1PTGDR
SCHEMBL8858394 0.85 PTGIR (0.60) PTGIRTBXAS1
SCHEMBL9048378 0.85 PTGIR (0.68) PTGIRTBXAS1
SCHEMBL8858398 0.84 PTGIR (0.59) PTGIRTBXAS1
SCHEMBL9046367 0.83 PTGIR (0.39) PTGIR
SCHEMBL9048143 0.82 PTGIR (0.70) PTGIRTBXAS1
SCHEMBL9048873 0.79 PTGIR (0.42) PTGIRTBXAS1PTGDR
SCHEMBL9049479 0.79 PTGIR (0.59) PTGIRPTGDR

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 4 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-5596009-A TREATMENT OF THROMBOSIS, ATHERIOSCLEROSIS, ANTIISCHEMIC AGENTS, ANTIULCER AGENTS OR HYPOTENSIVE AGENTS ONO PHARMACEUTICAL CO., LTD. (JP) 1997-01-21 US disclosed
EP-0542203-B1 Fused benzeneoxyacetic acid derivatives as PGl2 receptor agonists ONO PHARMACEUTICAL CO (JP) 1996-07-03 EP disclosed
US-5344836-A Fused benzeneoxyacetic acid derivatives ONO PHARMACEUTICAL CO., LTD. (JP) 1994-09-06 US disclosed