SCHEMBL7778633

SCHEMBL7778633

CCOC(=O)COc1cccc2c1CCC(COC(=O)N(c1ccccc1)c1ccccc1)C2

nearest known ligand 0.80

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PTGIR P43119 20/20 0.80
PTGDR Q13258 3/20 0.48
PTGER1 P34995 1/20 0.48
PTGER3 P43115 1/20 0.48

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
SCHEMBL7776687 0.91 PTGIR (0.82) PTGIRPTGDRPTGER1PTGER3
SCHEMBL7772432 0.91 PTGIR (0.66) PTGIRPTGDRPTGER1PTGER3
SCHEMBL7772466 0.89 PTGIR (1.00) PTGIRPTGDRPTGER1PTGER3
SCHEMBL7779671 0.85 PTGIR (0.77) PTGIRPTGDR
SCHEMBL7713222 0.83 PTGIR (0.89) PTGIRPTGDRPTGER1PTGER3
SCHEMBL9005622 0.82 PTGIR (0.64) PTGIR
SCHEMBL9005652 0.82 PTGIR (0.52) PTGIRPTGDR
SCHEMBL9017276 0.80 PTGIR (0.52) PTGIRPTGDRPTGER1PTGER3
SCHEMBL7778570 0.80 PTGIR (0.52) PTGIRPTGDRPTGER1PTGER3
SCHEMBL7776682 0.80 PTGIR (0.52) PTGIRPTGDRPTGER1PTGER3

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-0749424-B1 NAPHTHALENE DERIVATIVES AS PROSTAGLANDIN I2 AGONISTS FUJISAWA PHARMACEUTICAL CO (JP) 2001-09-12 EP disclosed
EP-0749424-A1 NAPHTHALENE DERIVATIVES AS PROSTAGLANDIN I2 AGONISTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1996-12-27 EP disclosed
WO-1995024393-A1 NAPHTHALENE DERIVATIVES AS PROSTAGLANDIN I2 AGONISTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1995-09-14 WO disclosed