SCHEMBL4734793

SCHEMBL4734793

CCC1(C(C/C=C/[C@@H]2[C@@H](CC=CCCCC(=O)O)[C@@H](OS(C)(=O)=O)C[C@H]2O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)CCC1

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PTGER2 P43116 2/20 0.47
PTGIR P43119 2/20 0.47
PTGER1 P34995 3/20 0.39
PTGER3 P43115 3/20 0.39
PTGER4 P35408 2/20 0.39
PDE4D Q08499 1/20 0.36
TBXA2R P21731 4/20 0.34
ALDH1A1 P00352 2/20 0.34
LMNA P02545 2/20 0.34
PTGFR P43088 2/20 0.34
PTGDR Q13258 1/20 0.34
SLCO2A1 Q92959 1/20 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
SCHEMBL4734798 1.00 PTGER2 (0.47) PTGER2PTGIRPTGER1PTGER3PTGER4
SCHEMBL4734797 1.00 PTGER2 (0.47) PTGER2PTGIRPTGER1PTGER3PTGER4
SCHEMBL2053225 0.93 PDE4D (0.42) PTGER2PTGIRPTGER1PTGER3PTGER4
SCHEMBL2053223 0.93 PDE4D (0.42) PTGER2PTGIRPTGER1PTGER3PTGER4
SCHEMBL2053227 0.93 PDE4D (0.42) PTGER2PTGIRPTGER1PTGER3PTGER4
SCHEMBL1111542 0.93 PDE4D (0.42) PTGER2PTGIRPTGER1PTGER3PTGER4
SCHEMBL8092628 0.90 PTGER2 (0.48) PTGER2PTGIRPTGER1PTGER3PTGER4
SCHEMBL8079368 0.89 PTGER2 (0.54) PTGER2PTGIRPTGER1PTGER3PTGER4
SCHEMBL7583983 0.89 PTGER2 (0.54) PTGER2PTGIRPTGER1PTGER3PTGER4
SCHEMBL7592328 0.88 PTGER2 (0.42) PTGER2PTGIRPTGER1PTGER3PTGER4

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
WO-2008073752-A2 CYCLOBUTYL DERIVATIVES FOR THE TREATMENT OF GLAUCOMA ALLERGAN, INC. (US) 2008-06-19 WO disclosed