SCHEMBL8410899

SCHEMBL8410899

CC(=O)Oc1cccc2c1CCC(Cn1cc(C(c3ccccc3)c3ccccc3)cn1)=C2

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGIR P43119 4/20 0.76
TAS2R8 Q9NYW2 5/20 0.33
ACACB O00763 2/20 0.33
ALDH1A1 P00352 3/20 0.32
MAPT P10636 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
LMNA P02545 1/20 0.32
KDM4E B2RXH2 1/20 0.32
ESR1 P03372 1/20 0.32
ITGB3 P05106 1/20 0.32
ITGA2B P08514 1/20 0.32
HMGB1 P09429 1/20 0.32
HPGD P15428 1/20 0.32
TSHR P16473 1/20 0.32
GGT1 P19440 1/20 0.32
PTGS1 P23219 1/20 0.32
PTGS2 P35354 1/20 0.32
BLM P54132 1/20 0.32
NAPRT Q6XQN6 1/20 0.32
HSD17B10 Q99714 1/20 0.32

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
SCHEMBL8411189 0.94 PTGIR (0.68) PTGIRMAPTNPSR1TSHRSLC6A2
SCHEMBL8812368 0.93 PTGIR (0.67) PTGIRACACBALDH1A1MAPTNPSR1
SCHEMBL8410896 0.86 PTGIR (1.00) PTGIRALDH1A1SMN1; SMN2
SCHEMBL8811347 0.84 PTGIR (0.56) PTGIRALDH1A1MAPTNPSR1HPGD
SCHEMBL8411186 0.81 PTGIR (0.88) PTGIRSLC6A2SLC6A4SLC6A3
SCHEMBL8811711 0.80 PTGIR (0.86) PTGIRALDH1A1SMN1; SMN2
SCHEMBL8414334 0.74 PTGIR (0.44) PTGIRALDH1A1MAPTKDM4EESR1
SCHEMBL8411099 0.74 PTGIR (0.69) PTGIR
SCHEMBL8410742 0.74 PTGIR (0.77) PTGIR
SCHEMBL8412744 0.73 PTGIR (0.42) PTGIRALDH1A1LMNAKDM4EESR1

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
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