SCHEMBL8812372

SCHEMBL8812372

O=C(O)COc1cccc2c1CCC(Cn1cc(Cc3ccccc3-c3cccc(Cl)c3)cn1)=C2

nearest known ligand 0.59

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PTGIR P43119 8/20 0.59
PTGDR Q13258 3/20 0.41
PLA2G1B P04054 4/20 0.37
HTT P42858 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
ATG4B Q9Y4P1 1/20 0.37
PTGDR2 Q9Y5Y4 3/20 0.37
PLA2G2A P14555 3/20 0.35
ALDH1A1 P00352 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
HTR7 P34969 1/20 0.34

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
SCHEMBL8411192 0.89 PTGIR (0.61) PTGIRPTGDRPLA2G1BHTTL3MBTL1
SCHEMBL8813614 0.80 PTGIR (0.43) PTGIRPTGDRPLA2G1BHTTL3MBTL1
SCHEMBL8811346 0.80 PTGIR (0.66) PTGIRPTGDR
SCHEMBL8811711 0.79 PTGIR (0.86) PTGIRPTGDRPTGDR2PLA2G2AALDH1A1
SCHEMBL8811350 0.79 PTGIR (0.59) PTGIRPTGDRPLA2G1BPTGDR2PLA2G2A
SCHEMBL8814204 0.78 PTGIR (0.53) PTGIRPTGDR
SCHEMBL8410896 0.75 PTGIR (1.00) PTGIRPTGDRPTGDR2ALDH1A1SMN1; SMN2
SCHEMBL8411186 0.70 PTGIR (0.88) PTGIR
SCHEMBL8411299 0.69 PTGIR (0.41) PTGIRPTGDRPLA2G1BHTTPLA2G2A
SCHEMBL8413362 0.69 PTGIR (0.62) 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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
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