SCHEMBL7717833

SCHEMBL7717833

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

nearest known ligand 0.71

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PTGIR P43119 19/20 0.71
PTGDR Q13258 3/20 0.71
PTGER1 P34995 1/20 0.71
PTGER3 P43115 1/20 0.71

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
SCHEMBL7716647 0.85 PTGIR (0.50) PTGIRPTGDRPTGER1PTGER3
SCHEMBL7778677 0.83 PTGIR (1.00) PTGIRPTGDRPTGER1PTGER3
SCHEMBL6612991 0.83 PTGIR (1.00) PTGIRPTGDRPTGER1PTGER3
SCHEMBL29760759 0.83 PTGIR (1.00) PTGIRPTGDRPTGER1PTGER3
SCHEMBL6612986 0.83 PTGIR (1.00) PTGIRPTGDRPTGER1PTGER3
SCHEMBL8078275 0.83 PTGIR (0.48) PTGIRPTGDRPTGER1PTGER3
SCHEMBL7717816 0.82 PTGIR (0.49) PTGIRPTGDRPTGER1PTGER3
SCHEMBL7713209 0.82 PTGIR (0.67) PTGIRPTGDRPTGER1PTGER3
SCHEMBL7777223 0.81 PTGIR (0.78) PTGIRPTGDRPTGER1PTGER3
SCHEMBL7779787 0.81 PTGIR (1.00) 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
US-6384072-B1 CARBAMYL SUBSTITUTED COMPOUNDS WITH ETHER GROUPS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-05-07 US disclosed
EP-1030834-A1 BENZOCYCLOHEPTENE DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2000-08-30 EP disclosed
WO-1999024397-A1 BENZOCYCLOHEPTENE DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1999-05-20 WO disclosed