SCHEMBL6865073

SCHEMBL6865073

Cc1nn(-c2cccc3cc(Cc4cc(F)cc(F)c4)sc23)c(C)c1C(N)=O

nearest known ligand 0.56

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
GPR52 Q9Y2T5 16/20 0.56
WNT3A P56704 3/20 0.37
PDE4B Q07343 1/20 0.35

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
SCHEMBL13505508 0.91 GPR52 (0.56) GPR52WNT3APDE4B
SCHEMBL6864696 0.88 GPR52 (0.61) GPR52WNT3A
SCHEMBL13506464 0.88 GPR52 (0.54) GPR52PDE4B
SCHEMBL6863958 0.87 GPR52 (0.59) GPR52WNT3APDE4B
SCHEMBL6865110 0.85 GPR52 (0.76) GPR52WNT3A
SCHEMBL13505722 0.85 GPR52 (0.53) GPR52WNT3APDE4B
SCHEMBL6865015 0.85 GPR52 (0.76) GPR52
SCHEMBL6865118 0.85 GPR52 (0.55) GPR52WNT3A
SCHEMBL13506218 0.83 GPR52 (0.57) GPR52WNT3A
SCHEMBL13505947 0.82 PDE4B (0.52) GPR52PDE4B

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-2518054-A1 AMIDE COMPOUND Takeda Pharmaceutical Company Limited (JP) 2012-10-31 EP disclosed
WO-2011078360-A1 AMIDE COMPOUND 武田薬品工業株式会社 (JP) 2011-06-30 WO disclosed