SCHEMBL8414332

SCHEMBL8414332

O=C(O)COc1cccc2c1CCC(Cc1cc(C(c3ccccc3)c3ccccc3)on1)=C2

nearest known ligand 0.59

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PTGIR P43119 19/20 0.59
TBXA2R P21731 3/20 0.36
KDM4E B2RXH2 1/20 0.34
ALDH1A1 P00352 1/20 0.34
HPGD P15428 1/20 0.34
TDP1 Q9NUW8 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
SCHEMBL8414334 0.86 PTGIR (0.44) PTGIRKDM4EALDH1A1HPGDTDP1
SCHEMBL8412741 0.85 PTGIR (0.58) PTGIRKDM4EALDH1A1HPGDTDP1
SCHEMBL8414097 0.79 PTGIR (0.58) PTGIRTBXA2RKDM4EALDH1A1HPGD
SCHEMBL8411284 0.75 PTGIR (0.50) PTGIRKDM4EALDH1A1HPGDTDP1
SCHEMBL8414345 0.75 PTGIR (0.55) PTGIRTBXA2RKDM4EALDH1A1HPGD
SCHEMBL8410896 0.74 PTGIR (1.00) PTGIRALDH1A1
SCHEMBL8411139 0.74 PTGIR (0.61) PTGIR
SCHEMBL8411187 0.74 PTGIR (0.46) PTGIR
SCHEMBL8809301 0.74 PTGIR (0.46) PTGIR
SCHEMBL8411290 0.73 PTGIR (0.56) PTGIRKDM4EALDH1A1HPGDTDP1

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 8 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
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