SCHEMBL1852519

SCHEMBL1852519

FC(F)(F)c1cccc(Cc2cc3cccc(Br)c3o2)c1.O=C(O)c1cccc(-c2cccc3cc(Cc4cccc(C(F)(F)F)c4)oc23)c1

nearest known ligand 0.68

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GPR52 Q9Y2T5 10/20 0.68
NR4A2 P43354 2/20 0.42
MRGPRX4 Q96LA9 1/20 0.40
KDM4E B2RXH2 2/20 0.40
MEN1 O00255 1/20 0.40
ALDH1A1 P00352 1/20 0.40
KMT2A Q03164 1/20 0.40
PTGER1 P34995 1/20 0.38
PLA2G2A P14555 1/20 0.37
KDM4C Q9H3R0 1/20 0.37
PTPRC P08575 1/20 0.37
PTPN2 P17706 1/20 0.37
PTPN1 P18031 1/20 0.37
PTPN6 P29350 1/20 0.37
PTPN9 P43378 1/20 0.37
DUSP3 P51452 1/20 0.37
PTPN11 Q06124 1/20 0.37
PTPN22 Q9Y2R2 1/20 0.37
PKM P14618 1/20 0.37

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
SCHEMBL1849964 0.94 GPR52 (0.75) GPR52NR4A2MRGPRX4KDM4EMEN1
SCHEMBL1850184 0.83 GPR52 (0.60) GPR52NR4A2MRGPRX4KDM4EMEN1
SCHEMBL1847848 0.83 GPR52 (0.51) GPR52
SCHEMBL1854347 0.81 GPR52 (0.56) GPR52NR4A2MRGPRX4PTGER1PLA2G2A
SCHEMBL1849703 0.81 GPR52 (0.57) GPR52NR4A2MRGPRX4KDM4EMEN1
SCHEMBL1851771 0.81 GPR52 (1.00) GPR52MRGPRX4
SCHEMBL3209952 0.80 GPR52 (0.76) GPR52MRGPRX4ALDH1A1
SCHEMBL3212711 0.80 GPR52 (0.55) GPR52NR4A2PTGER1PLA2G2A
SCHEMBL1851338 0.79 GPR52 (0.69) GPR52NR4A2MRGPRX4PTGER1
SCHEMBL1850535 0.79 GPR52 (0.55) GPR52NR4A2MRGPRX4KDM4EMEN1

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