SCHEMBL19940286

SCHEMBL19940286

FC(F)(F)Cc1ccc(CSSSCc2ccccn2)cc1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.41
LMNA P02545 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.40
NPC1 O15118 4/20 0.39
RAB9A P51151 4/20 0.39
SMN1; SMN2 Q16637 4/20 0.39
KDM4E B2RXH2 2/20 0.38
ALDH1A1 P00352 2/20 0.37
CYP1A2 P05177 1/20 0.37
TSHR P16473 1/20 0.37
KCNH2 Q12809 1/20 0.37
SCN5A Q14524 1/20 0.37
SCN9A Q15858 1/20 0.37
FDPS P14324 1/20 0.35
CETP P11597 1/20 0.34
HRH1 P35367 1/20 0.34

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
SCHEMBL13610341 0.83 RAB9A (0.45) MAPTLMNAL3MBTL1NPC1RAB9A
SCHEMBL13610373 0.82 MEN1 (0.45) MAPTLMNAKCNH2SCN5ASCN9A
SCHEMBL13610296 0.77 ALDH1A1 (0.51) MAPTLMNANPC1RAB9ASMN1; SMN2
SCHEMBL13610389 0.76 ALDH1A1 (0.47) MAPTRAB9AKDM4EALDH1A1
SCHEMBL13780226 0.74 SMN1; SMN2 (0.47) MAPTLMNANPC1RAB9ASMN1; SMN2
SCHEMBL31028455 0.73 FDPS (0.52) MAPTL3MBTL1NPC1RAB9ASMN1; SMN2
SCHEMBL146973 0.73 FDPS (0.52) MAPTL3MBTL1NPC1RAB9ASMN1; SMN2
SCHEMBL11445226 0.73 SMN1; SMN2 (0.57) MAPTLMNANPC1RAB9ASMN1; SMN2
SCHEMBL13610473 0.72 ABCB1 (0.44) MAPTLMNANPC1RAB9ASMN1; SMN2
SCHEMBL13610454 0.70 ALDH1A1 (0.43) MAPTLMNANPC1RAB9ASMN1; SMN2

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-1742635-B1 SUBSTITUTED ORGANOSULFUR COMPOUNDS AND METHODS OF USING THEREOF ACEA BIOSCIENCES INC (US) 2018-03-07 EP disclosed