SCHEMBL9047459

SCHEMBL9047459

CN(CC1CCc2c(cccc2OC(=O)CO)C1)C(=O)CN(c1ccccc1)c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PTGIR P43119 19/20 0.44
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
ACHE P22303 1/20 0.37
PTGDR Q13258 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
SCHEMBL9049474 0.91 PTGIR (0.43) PTGIRCA1CA2ACHE
SCHEMBL9047450 0.89 PTGIR (0.46) PTGIRCA1CA2ACHE
SCHEMBL9050740 0.87 PTGIR (0.42) PTGIR
SCHEMBL8858528 0.86 PTGIR (0.61) PTGIRPTGDR
SCHEMBL9047707 0.83 PTGIR (0.41) PTGIR
SCHEMBL9050993 0.81 PTGIR (0.39) PTGIRCA1CA2ACHE
SCHEMBL9048873 0.79 PTGIR (0.42) PTGIRCA1CA2ACHEPTGDR
SCHEMBL9048569 0.77 PTGIR (0.47) PTGIR
SCHEMBL9049479 0.77 PTGIR (0.59) PTGIRPTGDR
SCHEMBL9045695 0.76 MTNR1A (0.44) PTGIRCA1CA2ACHE

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 3 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
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