SCHEMBL1853149

SCHEMBL1853149

CCOC(=O)c1cccc(-c2cccc3cc(Cc4ccc(F)c(OC)c4)sc23)c1.COc1cc(Cc2cc3cccc(-c4cccc(C(=O)NCCC#N)c4)c3s2)ccc1F

nearest known ligand 0.55

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
GPR52 Q9Y2T5 12/20 0.55
KIFC1 Q9BW19 7/20 0.39
KISS1R Q969F8 1/20 0.36

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
SCHEMBL3215617 0.94 GPR52 (0.60) GPR52KISS1R
SCHEMBL3196491 0.89 GPR52 (0.52) GPR52
SCHEMBL1858447 0.85 GPR52 (0.49) GPR52
SCHEMBL3208882 0.85 GPR52 (0.73) GPR52
SCHEMBL3211306 0.85 GPR52 (0.60) GPR52KISS1R
SCHEMBL1850527 0.83 GPR52 (0.61) GPR52KISS1R
SCHEMBL1850789 0.81 GPR52 (0.53) GPR52
SCHEMBL1852650 0.80 GPR52 (0.68) GPR52KIFC1
SCHEMBL1851150 0.79 GPR52 (0.81) GPR52
SCHEMBL1853198 0.78 GPR52 (0.54) GPR52

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