SCHEMBL7583628

SCHEMBL7583628

CCC1(C(O)C/C=C/[C@H]2[C@H](OC)CC(=O)[C@@H]2C/C=C\CCCC(=O)OC)CCC1

nearest known ligand 0.67

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PTGIR P43119 6/20 0.55
PTGER2 P43116 5/20 0.55
PTGER4 P35408 4/20 0.43
PTGER3 P43115 3/20 0.43
PTGER1 P34995 1/20 0.39

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
SCHEMBL7585085 0.93 PTGIR (0.65) PTGIRPTGER2PTGER4PTGER3
SCHEMBL7172159 0.92 PTGIR (0.59) PTGIRPTGER2PTGER4PTGER3PTGER1
SCHEMBL8092606 0.92 PTGIR (0.59) PTGIRPTGER2PTGER4PTGER3PTGER1
SCHEMBL8090827 0.92 PTGIR (0.59) PTGIRPTGER2PTGER4PTGER3PTGER1
SCHEMBL7591354 0.92 PTGIR (0.54) PTGIRPTGER2PTGER4PTGER3PTGER1
SCHEMBL7584631 0.91 PTGIR (0.51) PTGIRPTGER2PTGER4PTGER3PTGER1
SCHEMBL7591983 0.90 PTGIR (0.68) PTGIRPTGER2PTGER4PTGER3PTGER1
SCHEMBL7176152 0.85 PTGIR (0.61) PTGIRPTGER2PTGER4PTGER3PTGER1
SCHEMBL7246257 0.85 PTGIR (0.46) PTGIRPTGER2PTGER4PTGER3PTGER1
SCHEMBL7688563 0.85 PTGIR (0.46) PTGIRPTGER2PTGER4PTGER3PTGER1

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 1 patent. 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 claimed