SCHEMBL196469

SCHEMBL196469

CC(CNC(=O)c1cc(F)cc2ccc(Cc3ccc(C(F)(F)F)cc3)n12)c1ccc(C(=O)O)cc1

nearest known ligand 0.43

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 19/20 0.43
PTGER2 P43116 1/20 0.42
SRD5A2 P31213 1/20 0.40
PTGDR Q13258 2/20 0.39
PTGER3 P43115 1/20 0.39

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
SCHEMBL1956768 0.88 PTGER4 (0.54) PTGER4PTGER2PTGDRPTGER3
SCHEMBL28484982 0.88 PTGER4 (0.54) PTGER4PTGER2PTGDRPTGER3
SCHEMBL196468 0.83 SRD5A2 (0.44) PTGER4PTGER2SRD5A2PTGDR
SCHEMBL23089018 0.83 PTGER4 (0.49) PTGER4PTGER2PTGDRPTGER3
SCHEMBL23089016 0.83 PTGER4 (0.49) PTGER4PTGER2PTGDRPTGER3
SCHEMBL28474778 0.81 PTGER4 (0.42) PTGER4PTGER2SRD5A2PTGDRPTGER3
SCHEMBL28474779 0.80 SRD5A2 (0.43) PTGER4PTGER2SRD5A2PTGER3
SCHEMBL1956758 0.78 PTGER4 (0.56) PTGER4PTGER2PTGDRPTGER3
SCHEMBL253776 0.78 PTGER4 (0.54) PTGER4PTGER2SRD5A2PTGDRPTGER3
SCHEMBL28477223 0.78 PTGER4 (0.56) PTGER4PTGER2PTGDRPTGER3

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
JP-2012500211-A 2012-01-05 JP claimed
EP-2320906-A1 HETEROCYCLIC AMIDE DERIVATIVES AS EP4 RECEPTOR ANTAGONISTS Beta Pharma Canada Inc. (CA) 2011-05-18 EP claimed
WO-2010019796-A1 HETEROCYCLIC AMIDE DERIVATIVES AS EP4 RECEPTOR ANTAGONISTS CHEMIETEK, LLC (US) 2010-02-18 WO claimed