SCHEMBL9660368

SCHEMBL9660368

FC(F)(F)c1ccc(N=NC2=NCCS2)c(C(F)(F)F)c1

nearest known ligand 0.37

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.37
RAB9A P51151 2/20 0.36
KMT2A Q03164 2/20 0.36
MAPT P10636 2/20 0.36
KDM4E B2RXH2 1/20 0.36
MEN1 O00255 1/20 0.36
LMNA P02545 1/20 0.36
HTT P42858 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
CASP3 P42574 1/20 0.35
SENP8 Q96LD8 1/20 0.35
SENP7 Q9BQF6 1/20 0.35
SENP6 Q9GZR1 1/20 0.35
CES2 O00748 2/20 0.33
ALDH1A1 P00352 1/20 0.32
ATM Q13315 1/20 0.32
POLQ O75417 1/20 0.31
HDAC8 Q9BY41 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
SCHEMBL9658738 0.85 NPC1 (0.36) NPC1RAB9AKMT2AMAPTKDM4E
SCHEMBL9658741 0.85 NPC1 (0.36) NPC1RAB9AKMT2AMAPTKDM4E
SCHEMBL9690044 0.82 KMT2A (0.43) NPC1RAB9AKMT2AMAPTKDM4E
SCHEMBL9690040 0.82 KMT2A (0.43) NPC1RAB9AKMT2AMAPTKDM4E
SCHEMBL9660705 0.80 ALDH1A1 (0.35) LMNAHTTSMN1; SMN2ALDH1A1
SCHEMBL9660909 0.80 KIF11 (0.39) RAB9AKMT2AMAPTKDM4EMEN1
SCHEMBL9660700 0.80 ALDH1A1 (0.35) LMNAHTTSMN1; SMN2ALDH1A1
SCHEMBL9661588 0.78 NPC1 (0.44) NPC1RAB9AKMT2AMAPTKDM4E
SCHEMBL9661581 0.78 NPC1 (0.44) NPC1RAB9AKMT2AMAPTKDM4E
SCHEMBL9690654 0.76 MAPT (0.55) NPC1RAB9AKMT2AMAPTKDM4E

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
EP-0520274-A2 2-(-4-substituted-phenylhydrazino)-2-thiazoline and 2-(-4-substituted phenylazo)-2-thiazoline, their preparation and their use against ectoparasites BAYER AG (DE) 1992-12-30 EP disclosed