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SCHEMBL1852510

SCHEMBL1852510

NC(=O)CNC(=O)c1cccc(-c2cccc3sc(Cc4ccc(F)c(F)c4)cc23)c1.O=C(O)c1cccc(-c2cccc3sc(Cc4ccc(F)c(F)c4)cc23)c1

nearest known ligand 0.57

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ GPR52 Q9Y2T5 8/20 0.57
▸ S1PR5 Q9H228 5/20 0.43
▸ KDM1A O60341 1/20 0.41
▸ PLA2G2A P14555 1/20 0.40
▸ S1PR4 O95977 3/20 0.38
▸ EPHX2 P34913 1/20 0.38
▸ NR1H4 Q96RI1 1/20 0.38
▸ SLC9A1 P19634 2/20 0.36
▸ SPHK2 Q9NRA0 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
SCHEMBL3209979 0.96 GPR52 (0.61) GPR52S1PR5KDM1AS1PR4SLC9A1
SCHEMBL1851699 0.89 GPR52 (0.52) GPR52S1PR5PLA2G2AS1PR4SLC9A1
SCHEMBL1852836 0.89 GPR52 (0.58) GPR52S1PR5KDM1AS1PR4SLC9A1
SCHEMBL7955979 0.88 GPR52 (0.51) GPR52S1PR5KDM1AS1PR4SLC9A1
SCHEMBL3223348 0.84 GPR52 (0.52) GPR52S1PR5PLA2G2AS1PR4SLC9A1
SCHEMBL3217946 0.84 GPR52 (0.79) GPR52KDM1ASPHK2
SCHEMBL1851157 0.83 GPR52 (0.57) GPR52SLC9A1
SCHEMBL3217825 0.83 GPR52 (0.75) GPR52S1PR5KDM1AS1PR4
SCHEMBL3219486 0.82 GPR52 (0.79) GPR52SLC9A1
SCHEMBL3204361 0.81 GPR52 (0.59) GPR52S1PR5S1PR4

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