SCHEMBL9048633

SCHEMBL9048633

O=C(O)C(=O)c1cccc2c1CCC(C(=O)NOC(c1ccccc1)c1ccccc1)C2

nearest known ligand 0.38

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PTGIR P43119 9/20 0.38
EPHX2 P34913 1/20 0.35
S1PR5 Q9H228 1/20 0.32
P2RX7 Q99572 1/20 0.32
GHSR Q92847 1/20 0.32
LMNA P02545 1/20 0.32
F2 P00734 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
SCHEMBL9045869 0.83 LMNA (0.51) EPHX2LMNA
SCHEMBL9568170 0.82 P2RX7 (0.45) EPHX2P2RX7GHSRLMNAF2
SCHEMBL9046598 0.82 POLB (0.41) PTGIREPHX2P2RX7GHSR
SCHEMBL9048858 0.82 PTGIR (0.46) PTGIR
SCHEMBL9048642 0.80 PTGIR (0.62) PTGIR
SCHEMBL9048637 0.80 PTGIR (0.45) PTGIREPHX2S1PR5
SCHEMBL9046164 0.76 PTGIR (0.37) PTGIR
SCHEMBL9048971 0.73 PTGIR (0.37) PTGIRLMNA
SCHEMBL9427232 0.70 PTGIR (0.36) PTGIR
SCHEMBL9048118 0.70 PTGIR (0.36) PTGIRS1PR5

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0542203-B1 Fused benzeneoxyacetic acid derivatives as PGl2 receptor agonists ONO PHARMACEUTICAL CO (JP) 1996-07-03 EP claimed
US-5344836-A Fused benzeneoxyacetic acid derivatives ONO PHARMACEUTICAL CO., LTD. (JP) 1994-09-06 US claimed