SCHEMBL6925779

SCHEMBL6925779

Cc1c(-c2cc(F)c(Cl)c(F)c2)csc1N

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.38
MAPT P10636 1/20 0.38
RAB9A P51151 1/20 0.38
GFER P55789 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
PRKCZ Q05513 6/20 0.35
EPHB4 P54760 1/20 0.32
ALOX5AP P20292 1/20 0.31
FEN1 P39748 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
SCHEMBL6927085 0.82 PRKCZ (0.41) NPC1MAPTRAB9AGFERSMN1; SMN2
SCHEMBL6927702 0.74 PRKCZ (0.43) MAPTPRKCZ
SCHEMBL6925740 0.73 PRKCZ (0.40) NPC1MAPTRAB9AGFERSMN1; SMN2
SCHEMBL6927294 0.73 PRKCZ (0.54) NPC1MAPTRAB9AGFERSMN1; SMN2
SCHEMBL15674527 0.64
SCHEMBL1167821 0.63
SCHEMBL6926287 0.63 POLB (0.36) MAPTPRKCZ
SCHEMBL23205871 0.61 CD44 (0.36) MAPT
SCHEMBL13614897 0.61 PTPRC (0.47) NPC1MAPTALOX5APFEN1
SCHEMBL13446768 0.61 FEN1 (0.40) ALOX5APFEN1

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-2011109551-A2 COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM CALCIMEDICA INC. (US) 2011-09-09 WO disclosed