SCHEMBL8090822

SCHEMBL8090822

CCCC1(C(C/C=C/[C@@H]2[C@@H](C/C=C\CCCC(=O)O)[C@@H](Cl)C[C@H]2O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)CCC1

nearest known ligand 0.54

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PTGER2 P43116 4/20 0.54
PTGIR P43119 2/20 0.54
PTGER3 P43115 4/20 0.49
PTGER1 P34995 3/20 0.49
PTGER4 P35408 2/20 0.49
ALDH1A1 P00352 2/20 0.37
TBXA2R P21731 2/20 0.37
PTGFR P43088 2/20 0.37
LMNA P02545 1/20 0.37
PTGDR Q13258 1/20 0.37
SLCO2A1 Q92959 1/20 0.37

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
SCHEMBL7600274 0.94 PTGER2 (0.59) PTGER2PTGIRPTGER3PTGER1PTGER4
SCHEMBL8087920 0.94 PTGER2 (0.59) PTGER2PTGIRPTGER3PTGER1PTGER4
SCHEMBL7590855 0.92 PTGER2 (0.49) PTGER2PTGIRPTGER3PTGER1PTGER4
SCHEMBL7588668 0.92 PTGER2 (0.49) PTGER2PTGIRPTGER3PTGER1PTGER4
SCHEMBL7591974 0.90 PTGER2 (0.43) PTGER2PTGIRPTGER3PTGER1PTGER4
SCHEMBL7584569 0.90 PTGER2 (0.43) PTGER2PTGIRPTGER3PTGER1PTGER4
SCHEMBL8079368 0.85 PTGER2 (0.54) PTGER2PTGIRPTGER3PTGER1PTGER4
SCHEMBL7583983 0.85 PTGER2 (0.54) PTGER2PTGIRPTGER3PTGER1PTGER4
SCHEMBL7582636 0.83 PTGER2 (0.46) PTGER2PTGIRPTGER3PTGER1PTGER4
SCHEMBL8092628 0.83 PTGER2 (0.48) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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