SCHEMBL1853382

SCHEMBL1853382

COCCNC(=O)c1cc(C)nc(-c2cccc3cc(Cc4cccc(C(F)(F)F)c4)sc23)c1.Cc1cc(C(=O)O)cc(-c2cccc3cc(Cc4cccc(C(F)(F)F)c4)sc23)n1

nearest known ligand 0.71

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GPR52 Q9Y2T5 18/20 0.71
PTGER4 P35408 1/20 0.42
PTGER2 P43116 1/20 0.42
SCD O00767 1/20 0.41

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
SCHEMBL3221330 0.97 GPR52 (0.75) GPR52SCD
SCHEMBL1847701 0.90 GPR52 (0.58) GPR52PTGER4PTGER2
SCHEMBL3213639 0.87 GPR52 (0.79) GPR52SCD
SCHEMBL1850555 0.86 GPR52 (0.61) GPR52SCD
SCHEMBL1848342 0.85 GPR52 (0.73) GPR52SCD
SCHEMBL1849557 0.83 GPR52 (1.00) GPR52
SCHEMBL1851868 0.83 GPR52 (0.83) GPR52
SCHEMBL3204383 0.82 GPR52 (0.82) GPR52
SCHEMBL6864379 0.82 GPR52 (0.69) GPR52SCD
SCHEMBL6866406 0.82 GPR52 (0.71) GPR52SCD

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-2323978-A1 AMIDE COMPOUND Takeda Pharmaceutical Company Limited (JP) 2011-05-25 EP disclosed
WO-2010018874-A1 AMIDE COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-02-18 WO disclosed