SCHEMBL1847633

SCHEMBL1847633

Cc1sc2ccn(Cc3ccc(C(F)(F)F)cc3)c2c1C(=O)NCCc1ccc(C(=O)O)cc1

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 8/20 0.47
PTGDR Q13258 4/20 0.47
PTGER2 P43116 3/20 0.45
TBXA2R P21731 1/20 0.45
PTGER1 P34995 1/20 0.45
PTGFR P43088 1/20 0.45
PTGER3 P43115 1/20 0.45
HTT P42858 1/20 0.43
MAPT P10636 1/20 0.42
NAMPT P43490 1/20 0.40
P2RY14 Q15391 1/20 0.40
PPARA Q07869 1/20 0.40
TMEM97 Q5BJF2 1/20 0.40
SIGMAR1 Q99720 1/20 0.40

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
SCHEMBL1847632 0.84 PTGER4 (0.66) PTGER4PTGDRPTGER2PTGER3
SCHEMBL1954049 0.84 PTGER4 (0.66) PTGER4PTGDRPTGER2PTGER3
SCHEMBL1842802 0.83 PTGER4 (0.43) PTGER4PTGDRPTGER2TBXA2RPTGER1
SCHEMBL1844421 0.82 PTGER4 (0.48) PTGER4PTGDRPTGER2TBXA2RPTGER1
SCHEMBL196448 0.82 PTGER4 (0.67) PTGER4PTGDRPTGER2TBXA2RPTGER1
Diethanolamine SCHEMBL28521337 0.79 PTGER4 (0.60) PTGER4PTGDRPTGER2TBXA2RPTGER1
Tromethamine SCHEMBL22633156 0.79 PTGER4 (0.62) PTGER4PTGDRPTGER2TBXA2RPTGER1
SCHEMBL16524288 0.79 PTGER4 (0.69) PTGER4PTGER2MAPTPPARA
SCHEMBL1845684 0.78 KDM4E (0.44) PTGER4PTGDRPTGER2TBXA2RPTGER1
SCHEMBL32684475 0.74 PTGER4 (0.43) PTGER4PTGDRPTGER2TBXA2RPTGER1

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