SCHEMBL4564952

SCHEMBL4564952

CC(NC(=O)c1cc(Cl)ccc1COc1cc(F)ccc1F)c1ccc(C(=O)O)cc1

nearest known ligand 0.63

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 16/20 0.63
PTGER2 P43116 5/20 0.63
PTGDR Q13258 1/20 0.47
PTGER1 P34995 1/20 0.46

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
SCHEMBL692467 1.00 PTGER4 (0.63) PTGER4PTGER2PTGDRPTGER1
SCHEMBL691162 0.94 PTGER4 (0.65) PTGER4PTGER2PTGDRPTGER1
SCHEMBL22076508 0.94 PTGER4 (0.65) PTGER4PTGER2PTGDRPTGER1
SCHEMBL690929 0.93 PTGER4 (0.67) PTGER4PTGER2PTGDR
SCHEMBL5512186 0.92 PTGER4 (0.52) PTGER4PTGER2
SCHEMBL3982055 0.92 PTGER4 (0.52) PTGER4PTGER2
SCHEMBL4017242 0.90 PTGER4 (0.67) PTGER4PTGER2PTGER1
SCHEMBL691307 0.89 PTGER4 (0.61) PTGER4PTGER2PTGDR
SCHEMBL691179 0.89 PTGER4 (0.68) PTGER4PTGER2PTGDRPTGER1
SCHEMBL26914669 0.89 PTGER4 (0.68) PTGER4PTGER2PTGDRPTGER1

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-2005102389-A9 COMBINATIONS COMPRISING ALPHA-2-DELTA LIGANDS AND EP4 RECEPTOR ANTAGONISTS PFIZER PROD INC (US) 2009-04-30 WO disclosed