SCHEMBL8410973

SCHEMBL8410973

CC(=O)NOc1cccc2c1CCC(Cn1cc(C(c3ccccc3)c3ccccc3)cn1)C2

nearest known ligand 0.73

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PTGIR P43119 18/20 0.73
PTGDR Q13258 2/20 0.43
TBXAS1 P24557 1/20 0.42
MTNR1A P48039 1/20 0.40
MTNR1B P49286 1/20 0.40

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
SCHEMBL8410742 0.88 PTGIR (0.77) PTGIRPTGDRTBXAS1
SCHEMBL8808641 0.87 PTGIR (0.75) PTGIRPTGDRTBXAS1
SCHEMBL8413473 0.86 PTGIR (0.76) PTGIRPTGDRTBXAS1
SCHEMBL8413469 0.85 PTGIR (0.84) PTGIRPTGDRTBXAS1
SCHEMBL8410969 0.85 PTGIR (0.86) PTGIRPTGDR
SCHEMBL8410741 0.85 PTGIR (1.00) PTGIRPTGDR
SCHEMBL8413360 0.83 PTGIR (0.69) PTGIRPTGDRTBXAS1
SCHEMBL8811344 0.82 PTGIR (0.68) PTGIRPTGDRTBXAS1
SCHEMBL8519034 0.82 PTGIR (0.68) PTGIRPTGDRTBXAS1
SCHEMBL8412656 0.82 PTGIR (0.68) PTGIRPTGDRTBXAS1

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5962439-A CARDIOVASCULAR DISORDER ONO PHARMACEUTICAL CO., LTD. (JP) 1999-10-05 US disclosed
US-5849919-A Fused benzeneoxyacetic acid derivatives which have PGI2 receptor anonist activity ONO PHARMACEUTICAL CO., LTD. (JP) 1998-12-15 US disclosed
EP-0548949-B1 Fused benzeneoxyacetic acid derivatives ONO PHARMACEUTICAL CO (JP) 1997-09-17 EP disclosed
US-5589496-A Fused benzeneoxyacetic acid derivatives which have PGI2 receptor agonist activity ONO PHARMACEUTICAL CO., LTD. (JP) 1996-12-31 US disclosed
EP-0548949-A2 Fused benzeneoxyacetic acid derivatives ONO PHARMACEUTICAL CO., LTD. (JP) 1993-06-30 EP disclosed