SCHEMBL1853528

SCHEMBL1853528

CCOC(=O)c1ccc(-c2cccc3cc(Cc4cccc(C(F)(F)F)c4)sc23)nc1.O=C(O)c1ccc(-c2cccc3cc(Cc4cccc(C(F)(F)F)c4)sc23)nc1

nearest known ligand 0.51

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
GPR52 Q9Y2T5 14/20 0.51
SCD O00767 5/20 0.43

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
SCHEMBL1849417 0.97 GPR52 (0.53) GPR52SCD
SCHEMBL3219563 0.92 GPR52 (0.55) GPR52SCD
SCHEMBL1850092 0.88 GPR52 (0.59) GPR52SCD
SCHEMBL1863284 0.85 GPR52 (0.59) GPR52
SCHEMBL3209653 0.84 GPR52 (0.62) GPR52SCD
SCHEMBL1855306 0.84 GPR52 (0.69) GPR52
SCHEMBL1854179 0.83 GPR52 (0.62) GPR52SCD
SCHEMBL1853348 0.83 GPR52 (0.52) GPR52
SCHEMBL3263212 0.83 GPR52 (0.69) GPR52SCD
SCHEMBL1849247 0.81 GPR52 (0.60) 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