SCHEMBL8412795

SCHEMBL8412795

O=C(O)COc1cccc2c1CCCC2C=Cc1coc(Cc2ccccc2-c2cccnc2)n1

nearest known ligand 0.44

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TBXAS1 P24557 2/20 0.44
PTGIR P43119 11/20 0.39
PPARD Q03181 1/20 0.35
PLA2G1B P04054 2/20 0.33
LMNA P02545 1/20 0.33
KDM4C Q9H3R0 1/20 0.33
PTGDR Q13258 2/20 0.33
CD274 Q9NZQ7 1/20 0.33

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
SCHEMBL8809500 0.81 PTGIR (0.47) TBXAS1PTGIRKDM4C
SCHEMBL8811309 0.81 PTGIR (0.47) TBXAS1PTGIRKDM4C
SCHEMBL8413479 0.77 TBXAS1 (0.37) TBXAS1PTGIRPPARDPLA2G1BLMNA
SCHEMBL8410752 0.74 TBXAS1 (0.48) TBXAS1PTGIRPTGDR
SCHEMBL8811213 0.74 PTGDR2 (0.38) TBXAS1PTGIR
SCHEMBL8808600 0.74 PTGDR2 (0.38) TBXAS1PTGIR
SCHEMBL8414476 0.74 PTGDR2 (0.38) TBXAS1PTGIR
SCHEMBL8520586 0.74 PTGIR (0.45) TBXAS1PTGIRKDM4C
SCHEMBL8412819 0.73 PTGIR (0.47) TBXAS1PTGIRPPARDPLA2G1BLMNA
SCHEMBL8520476 0.72 PTGIR (0.64) TBXAS1PTGIRPLA2G1BKDM4CPTGDR

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 9 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 claimed
EP-0548949-B1 Fused benzeneoxyacetic acid derivatives ONO PHARMACEUTICAL CO (JP) 1997-09-17 EP claimed
EP-0548949-A2 Fused benzeneoxyacetic acid derivatives ONO PHARMACEUTICAL CO., LTD. (JP) 1993-06-30 EP claimed
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
US-5389666-A Administering for treatment and prevention of thrombosis, arteriosclerosis, ischemic heart diseases, gastric ulcer or hypertension ONO PHARMACEUTICAL CO., LTD. (JP) 1995-02-14 US disclosed
EP-0548949-A2 Fused benzeneoxyacetic acid derivatives ONO PHARMACEUTICAL CO., LTD. (JP) 1993-06-30 EP disclosed