SCHEMBL2516005

SCHEMBL2516005

CCOC(=O)Oc1cc(-c2cc(F)cc(Cl)c2)c(-c2cccc(C#N)c2)o1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 1/20 0.40
PGR P06401 1/20 0.38
PTGDR2 Q9Y5Y4 1/20 0.37
FNTA P49354 1/20 0.37
FNTB P49356 1/20 0.37
PDCD1 Q15116 1/20 0.37
CD274 Q9NZQ7 1/20 0.37
HRH2 P25021 1/20 0.36
HRH1 P35367 1/20 0.36
TLR8 Q9NR97 1/20 0.36
TLR7 Q9NYK1 1/20 0.36
ALOX5 P09917 2/20 0.35
MCHR1 Q99705 2/20 0.35
RORC P51449 1/20 0.34
ALDH1A1 P00352 1/20 0.34
LMNA P02545 1/20 0.34
METAP2 P50579 1/20 0.34
CHRM3 P20309 3/20 0.33
CYP1A2 P05177 1/20 0.33
GRM5 P41594 1/20 0.33

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
SCHEMBL2507675 0.94 PGR (0.40) CNR2PGRPTGDR2PDCD1CD274
SCHEMBL2506526 0.93 PGR (0.42) CNR2PGRFNTAFNTBPDCD1
SCHEMBL2509896 0.86 PGR (0.42) PGRALOX5MCHR1CHRM3GRM5
SCHEMBL419840 0.85 FNTA (0.42) CNR2PGRPTGDR2FNTAFNTB
SCHEMBL2484122 0.83 XPO1 (0.36) PGRALOX5ALDH1A1CHRM3
SCHEMBL2505963 0.80 FNTA (0.41) CNR2PGRPTGDR2FNTAFNTB
SCHEMBL2487648 0.79 ALOX5 (0.41) ALOX5ALDH1A1LMNACHRM3
SCHEMBL420126 0.79 ALOX5 (0.45) PGRPTGDR2FNTAFNTBTLR8
SCHEMBL2510358 0.78 CNR2 (0.44) CNR2PGRFNTAFNTBPDCD1
SCHEMBL420790 0.78 TLR8 (0.43) CNR2PGRFNTAFNTBPDCD1

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
EP-2376479-B1 SUBSTITUTED FURANCARBOXAMIDES, AND USE THEREOF AICURIS GMBH & CO KG (DE) 2016-03-02 EP disclosed
EP-2376479-A1 SUBSTITUTED FURANCARBOXAMIDES, AND USE THEREOF AiCuris GmbH & Co. KG (DE) 2011-10-19 EP disclosed
WO-2010075957-A1 SUBSTITUTED FURANCARBOXAMIDES, AND USE THEREOF AICURIS GMBH & CO. KG (DE) 2010-07-08 WO disclosed