SCHEMBL8813614

SCHEMBL8813614

O=C(O)COc1cccc2c1CCCC2=CCn1cc(Cc2ccccc2-c2cccc(Cl)c2)cn1

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PTGIR P43119 11/20 0.43
PTGDR Q13258 5/20 0.40
PTGDR2 Q9Y5Y4 5/20 0.36
PLA2G1B P04054 1/20 0.35
HTT P42858 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
ATG4B Q9Y4P1 1/20 0.35
PPARD Q03181 1/20 0.34
PPARA Q07869 1/20 0.34
PDE4B Q07343 1/20 0.33
FFAR1 O14842 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
SCHEMBL8411299 0.89 PTGIR (0.41) PTGIRPTGDRPLA2G1BHTTPPARD
SCHEMBL8813608 0.82 PTGIR (0.59) PTGIRPTGDRPTGDR2
SCHEMBL8809666 0.82 PTGIR (0.59) PTGIRPTGDRPTGDR2
SCHEMBL8809056 0.81 PTGIR (0.39) PTGIRPTGDRHTTPPARD
SCHEMBL8814204 0.81 PTGIR (0.53) PTGIRPTGDR
SCHEMBL8812372 0.80 PTGIR (0.59) PTGIRPTGDRPTGDR2PLA2G1BHTT
SCHEMBL8811346 0.79 PTGIR (0.66) PTGIRPTGDR
SCHEMBL8519368 0.76 ABL1 (0.33) PTGIRPTGDRPDE4B
SCHEMBL8810992 0.73 PTGIR (0.57) PTGIRHTT
SCHEMBL8411294 0.73 PTGIR (0.57) PTGIRHTT

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