SCHEMBL9050347

SCHEMBL9050347

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

nearest known ligand 0.48

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PTGIR P43119 8/20 0.48
TBXAS1 P24557 1/20 0.43
KDM4C Q9H3R0 3/20 0.36
SIGMAR1 Q99720 4/20 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
SCHEMBL9427127 0.83 PTGIR (0.43) PTGIRTBXAS1KDM4C
SCHEMBL9050999 0.80 PTGIR (0.48) PTGIRTBXAS1
SCHEMBL9046342 0.79 PTGIR (0.38) PTGIRTBXAS1
SCHEMBL9567999 0.79 TRPM8 (0.47) KDM4C
SCHEMBL9046599 0.79 PTGIR (0.41) PTGIRTBXAS1KDM4CSIGMAR1
SCHEMBL9048583 0.78 PTGIR (0.45) PTGIRTBXAS1KDM4CSIGMAR1
SCHEMBL9427217 0.78 PTGIR (0.45) PTGIRTBXAS1KDM4CSIGMAR1
SCHEMBL9049785 0.78 PTGIR (0.44) PTGIRTBXAS1KDM4CSIGMAR1
SCHEMBL9050860 0.78 PTGIR (0.45) PTGIRKDM4CSIGMAR1
SCHEMBL9048514 0.77 PTGIR (0.42) PTGIRTBXAS1KDM4CSIGMAR1

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