SCHEMBL8858441

SCHEMBL8858441

NC(C(=O)CC(c1ccccc1)c1ccccc1)C1CCc2c(cccc2OCC(=O)O)C1

nearest known ligand 0.58

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PTGIR P43119 19/20 0.58
TBXAS1 P24557 1/20 0.46
PTGDR Q13258 1/20 0.44

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
SCHEMBL9427242 0.82 PTGIR (0.59) PTGIRTBXAS1PTGDR
SCHEMBL9048122 0.82 PTGIR (0.58) PTGIRTBXAS1PTGDR
SCHEMBL9567970 0.80 TDP1 (0.39)
SCHEMBL9050333 0.78 PTGIR (0.56) PTGIRTBXAS1PTGDR
SCHEMBL8858447 0.77 PTGIR (0.65) PTGIRTBXAS1PTGDR
SCHEMBL9427367 0.76 PTGIR (0.56) PTGIRPTGDR
SCHEMBL8858408 0.75 PTGIR (0.63) PTGIRTBXAS1
SCHEMBL7772422 0.75 PTGIR (0.60) PTGIR
SCHEMBL9046604 0.75 PTGIR (0.63) PTGIRTBXAS1PTGDR
SCHEMBL8627438 0.75 PTGIR (0.50) 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 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-5596009-A TREATMENT OF THROMBOSIS, ATHERIOSCLEROSIS, ANTIISCHEMIC AGENTS, ANTIULCER AGENTS OR HYPOTENSIVE AGENTS ONO PHARMACEUTICAL CO., LTD. (JP) 1997-01-21 US disclosed