SCHEMBL7592328

SCHEMBL7592328

CCC1(C(C/C=C/[C@@H]2[C@@H](C/C=C\CCCC(=O)O)[C@@H](OS(=O)(=O)c3ccc(C)cc3)C[C@H]2O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)CCC1

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PTGER2 P43116 4/20 0.42
PTGIR P43119 2/20 0.42
TBXA2R P21731 3/20 0.37
PTGER3 P43115 2/20 0.36
PTGER1 P34995 1/20 0.36
PTGER4 P35408 1/20 0.36
PTGDR Q13258 2/20 0.35
PDE4D Q08499 1/20 0.33

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
SCHEMBL7592396 0.95 PTGER2 (0.39) PTGER2PTGIRTBXA2RPTGER3PTGER1
SCHEMBL4734798 0.88 PTGER2 (0.47) PTGER2PTGIRTBXA2RPTGER3PTGER1
SCHEMBL4734793 0.88 PTGER2 (0.47) PTGER2PTGIRTBXA2RPTGER3PTGER1
SCHEMBL4734797 0.88 PTGER2 (0.47) PTGER2PTGIRTBXA2RPTGER3PTGER1
SCHEMBL8092628 0.84 PTGER2 (0.48) PTGER2PTGIRPTGER3PTGER1PTGER4
SCHEMBL7583983 0.83 PTGER2 (0.54) PTGER2PTGIRTBXA2RPTGER3PTGER1
SCHEMBL8079368 0.83 PTGER2 (0.54) PTGER2PTGIRTBXA2RPTGER3PTGER1
SCHEMBL7600274 0.83 PTGER2 (0.59) PTGER2PTGIRTBXA2RPTGER3PTGER1
SCHEMBL8087920 0.83 PTGER2 (0.59) PTGER2PTGIRTBXA2RPTGER3PTGER1
SCHEMBL2053223 0.82 PDE4D (0.42) PTGER2PTGIRPTGER3PTGER1PTGER4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0860430-B1 Omega-cycloalkyl-prostaglandin E2 derivatives ONO PHARMACEUTICAL CO (JP) 2002-06-12 EP disclosed
US-6110969-A Cycloalkyl-prostaglandin E2 derivatives ONO PHARMACEUTICAL CO. LTD. (JP) 2000-08-29 US disclosed
EP-0860430-A2 Omega-cycloalkyl-prostaglandin E2 derivatives ONO PHARMACEUTICAL CO., LTD. (JP) 1998-08-26 EP disclosed