SCHEMBL20079455

SCHEMBL20079455

CCCC[n+]1ccn(CCSCCC[Si](OC)(OC)OC)c1

nearest known ligand 0.35

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.35
HSP90AA1 P07900 2/20 0.35
KMT2A Q03164 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
FDPS P14324 15/20 0.34
APAF1 O14727 1/20 0.32
NPC1 O15118 1/20 0.32
PLA2G1B P04054 1/20 0.32
MAPT P10636 1/20 0.32
MAPK1 P28482 1/20 0.32
HTT P42858 1/20 0.32
RAB9A P51151 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
ATG4B Q9Y4P1 1/20 0.32
PON1 P27169 1/20 0.32
PABPC1 P11940 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
Hydrochloric Acid SCHEMBL503784 0.85 MEN1 (0.42) MEN1HSP90AA1KMT2ASMN1; SMN2FDPS
SCHEMBL20079454 0.84 MEN1 (0.35) MEN1HSP90AA1KMT2ASMN1; SMN2FDPS
SCHEMBL17752921 0.84 MEN1 (0.43) MEN1HSP90AA1KMT2ASMN1; SMN2FDPS
Hydrochloric Acid SCHEMBL503783 0.83 PON1 (0.42) MEN1HSP90AA1KMT2ASMN1; SMN2FDPS
Iodide SCHEMBL29954380 0.83 MEN1 (0.42) MEN1HSP90AA1KMT2ASMN1; SMN2FDPS
Hydrochloric Acid SCHEMBL30639258 0.81 FDPS (0.37) MEN1HSP90AA1KMT2ASMN1; SMN2FDPS
Iodide SCHEMBL29954174 0.81 MEN1 (0.49) MEN1HSP90AA1KMT2ASMN1; SMN2FDPS
SCHEMBL16724670 0.80 MEN1 (0.42) MEN1HSP90AA1KMT2ASMN1; SMN2FDPS
SCHEMBL18079810 0.79 FDPS (0.44) MEN1HSP90AA1KMT2ASMN1; SMN2FDPS
Hydrochloric Acid SCHEMBL30360159 0.78 MEN1 (0.35) MEN1HSP90AA1KMT2ASMN1; SMN2FDPS

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
US-9954162-B2 Reactive ionic liquid, and ion-immobilized metal oxide particle, ion-immobilized elastomer, and transducer using same SUMITOMO RIKO COMPANY LIMITED (JP) 2018-04-24 US disclosed