SCHEMBL7776647

SCHEMBL7776647

CC1(O)CCc2c(OCC(=O)O)cccc2C1CCOC(=O)N(c1ccccc1)c1ccccc1

nearest known ligand 0.64

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PTGIR P43119 18/20 0.64
PTGDR Q13258 4/20 0.59
PTGER1 P34995 1/20 0.59
PTGER3 P43115 1/20 0.59
TBXAS1 P24557 1/20 0.37
PTGDR2 Q9Y5Y4 1/20 0.36

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
SCHEMBL7772426 0.91 PTGIR (0.54) PTGIRPTGDRPTGER1PTGER3
SCHEMBL7779788 0.83 PTGIR (0.45) PTGIRPTGDRPTGER1PTGER3
SCHEMBL7777405 0.79 PTGIR (0.56) PTGIRPTGDRPTGER1PTGER3PTGDR2
SCHEMBL7778533 0.79 PTGIR (0.67) PTGIRPTGDRPTGER1PTGER3TBXAS1
SCHEMBL7777534 0.79 PTGIR (0.60) PTGIRPTGDRPTGER1PTGER3TBXAS1
SCHEMBL7777531 0.79 PTGIR (0.60) PTGIRPTGDRPTGER1PTGER3TBXAS1
SCHEMBL7778516 0.79 PTGIR (0.60) PTGIRPTGDRPTGER1PTGER3TBXAS1
SCHEMBL9017294 0.79 PTGIR (0.49) PTGIRPTGDRPTGER1PTGER3PTGDR2
SCHEMBL7779787 0.78 PTGIR (1.00) PTGIRPTGDRPTGER1PTGER3PTGDR2
SCHEMBL7778549 0.77 PTGIR (0.56) PTGIRPTGDRPTGER1PTGER3TBXAS1

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-0749424-B1 NAPHTHALENE DERIVATIVES AS PROSTAGLANDIN I2 AGONISTS FUJISAWA PHARMACEUTICAL CO (JP) 2001-09-12 EP disclosed