SCHEMBL9048583

SCHEMBL9048583

NC(=O)C(CC1CCCc2c(OC(=O)CO)cccc21)CC(c1ccccc1)c1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PTGIR P43119 8/20 0.45
KDM4C Q9H3R0 3/20 0.37
TBXAS1 P24557 1/20 0.35
SIGMAR1 Q99720 3/20 0.35

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
SCHEMBL9049785 0.91 PTGIR (0.44) PTGIRKDM4CTBXAS1SIGMAR1
SCHEMBL9048934 0.83 PTGIR (0.39) PTGIR
SCHEMBL9427217 0.82 PTGIR (0.45) PTGIRKDM4CTBXAS1SIGMAR1
SCHEMBL9048514 0.81 PTGIR (0.42) PTGIRKDM4CTBXAS1SIGMAR1
SCHEMBL9048581 0.81 PTGIR (0.39) PTGIRKDM4C
SCHEMBL9050860 0.79 PTGIR (0.45) PTGIRKDM4CSIGMAR1
SCHEMBL9050347 0.78 PTGIR (0.48) PTGIRKDM4CTBXAS1SIGMAR1
SCHEMBL9568075 0.78 TRPM8 (0.48) KDM4C
SCHEMBL9050478 0.78 PTGIR (0.39) PTGIR
SCHEMBL9051195 0.78 TBXAS1 (0.44) PTGIRKDM4CTBXAS1

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