SCHEMBL9051667

SCHEMBL9051667

O=C(CO)Oc1cccc2c1CCCC2C(=O)NN=C(c1ccccc1)c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PTGIR P43119 2/20 0.44
DRD4 P21917 1/20 0.41
TBXAS1 P24557 1/20 0.40
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
ALDH1A1 P00352 1/20 0.38
RECQL P46063 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38

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
SCHEMBL9046310 0.86 PTGIR (0.61) PTGIRDRD4TBXAS1MEN1KMT2A
SCHEMBL9427064 0.80 LMNA (0.45) PTGIRDRD4
SCHEMBL9048139 0.80 DRD4 (0.47) PTGIRDRD4
SCHEMBL9050562 0.79 NPSR1 (0.43) PTGIRDRD4ALDH1A1NPSR1
SCHEMBL9048933 0.79 PTGIR (0.52) PTGIRDRD4
SCHEMBL9046170 0.78 PTGIR (0.44) PTGIRDRD4
SCHEMBL9048623 0.78 DRD4 (0.49) PTGIRDRD4
SCHEMBL9427127 0.76 PTGIR (0.43) PTGIRDRD4TBXAS1
SCHEMBL9050347 0.75 PTGIR (0.48) PTGIRTBXAS1
SCHEMBL9047483 0.75 ACHE (0.40) PTGIRDRD4MEN1KMT2A

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
EP-0542203-A2 Fused benzeneoxyacetic acid derivatives as PGl2 receptor agonists ONO PHARMACEUTICAL CO., LTD. (JP) 1993-05-19 EP claimed