SCHEMBL4685274

SCHEMBL4685274

Cc1cc(C(=O)O)nn1CCc1cc(Cl)ccc1OCc1c(F)cc(F)cc1F

nearest known ligand 0.67

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PTGER1 P34995 20/20 0.67

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
SCHEMBL4683989 0.90 PTGER1 (0.54) PTGER1
SCHEMBL4681756 0.90 PTGER1 (0.83) PTGER1
SCHEMBL4681009 0.89 PTGER1 (0.75) PTGER1
SCHEMBL4684058 0.88 PTGER1 (0.65) PTGER1
SCHEMBL4683923 0.87 PTGER1 (0.51) PTGER1
SCHEMBL4681592 0.87 PTGER1 (0.67) PTGER1
SCHEMBL4683482 0.84 PTGER1 (0.69) PTGER1
SCHEMBL4680488 0.83 PTGER1 (0.79) PTGER1
SCHEMBL4683884 0.80 PTGER1 (0.68) PTGER1
SCHEMBL4085124 0.80 PTGER1 (1.00) PTGER1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1675832-B1 HETEROCYCLYL COMPOUNDS GLAXO GROUP LTD (GB) 2008-02-20 EP claimed
EP-1675832-B1 HETEROCYCLYL COMPOUNDS GLAXO GROUP LTD (GB) 2008-02-20 EP disclosed