SCHEMBL19953097

SCHEMBL19953097

Cc1nc(Cl)n(-c2ccc(Cl)cc2)c1-c1c(F)ccc(Cl)c1F

nearest known ligand 0.60

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.33
KDM4E B2RXH2 1/20 0.33
BRD9 Q9H8M2 1/20 0.33
KCNH2 Q12809 1/20 0.32
AOC3 Q16853 1/20 0.32
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
GRM5 P41594 1/20 0.31
NPC1 O15118 1/20 0.31
GAA P10253 1/20 0.31
MAPT P10636 1/20 0.31
ALOX15 P16050 1/20 0.31
ALOX12 P18054 1/20 0.31
RAB9A P51151 1/20 0.31

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
SCHEMBL1075285 0.92 POLB (0.35) POLBKDM4EKCNH2AOC3MEN1
SCHEMBL19953205 0.89 POLB (0.36) POLBKDM4EBRD9GRM5
SCHEMBL1082336 0.86 PDE2A (0.40) POLBKDM4EGRM5NPC1MAPT
SCHEMBL1074869 0.83 AR (0.36) KDM4EMEN1KMT2AGAA
SCHEMBL1076468 0.82 POLB (0.37) POLBKDM4EKCNH2AOC3GRM5
SCHEMBL1076197 0.80 POLB (0.38) POLBKDM4EGRM5
SCHEMBL1074066 0.78 ALDH1A1 (0.34) KDM4ENPC1MAPTRAB9A
SCHEMBL1225604 0.78 GPBAR1 (0.35) NPC1MAPTRAB9A
SCHEMBL19967313 0.78 POLB (0.36) POLBKDM4EMEN1KMT2AGRM5
SCHEMBL1075011 0.77 GLA (0.40) POLBGAA

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2018048969-A1 MULTI-TARGETED HETEROCYCLIC COMPOUNDS FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2018-03-15 WO disclosed