SCHEMBL14600587

SCHEMBL14600587

CS(C)(C)C(c1nc2ccccc2o1)S(C)(C)C

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.44
NPC1 O15118 6/20 0.44
RAB9A P51151 5/20 0.44
LMNA P02545 2/20 0.44
GAA P10253 2/20 0.44
ALOX15 P16050 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
LOXL2 Q9Y4K0 1/20 0.43
PSMB8 P28062 1/20 0.42
TP53 P04637 4/20 0.41
SMN1; SMN2 Q16637 4/20 0.41
DDAH1 O94760 1/20 0.40
ADRA2C P18825 1/20 0.40
PTGS2 P35354 1/20 0.40
ALDH1A1 P00352 4/20 0.40
HPGD P15428 3/20 0.40
HSD17B10 Q99714 3/20 0.40
PKM P14618 2/20 0.40
KDM4E B2RXH2 2/20 0.40
MEN1 O00255 2/20 0.40

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
SCHEMBL10902610 0.79 MAPT (0.46) MAPTNPC1RAB9ALMNAGAA
SCHEMBL23342452 0.79 MAPT (0.46) MAPTNPC1RAB9ALMNAGAA
SCHEMBL2147325 0.79 MAPT (0.48) MAPTNPC1RAB9ALMNAGAA
SCHEMBL86097 0.79 MAPT (0.48) MAPTNPC1RAB9ALMNAGAA
SCHEMBL12915263 0.77 MAPT (0.47) MAPTNPC1RAB9ALMNAGAA
SCHEMBL28409963 0.76 NPC1 (0.50) MAPTNPC1RAB9ALMNAGAA
SCHEMBL8409764 0.76 NPC1 (0.46) MAPTNPC1RAB9ALMNAGAA
SCHEMBL8069919 0.76 MAPT (0.46) MAPTNPC1RAB9ALMNAGAA
SCHEMBL2123396 0.76 MAPT (0.50) MAPTNPC1RAB9ALMNAGAA
SCHEMBL12396620 0.76 MAPT (0.46) MAPTNPC1RAB9ALMNAGAA

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-20070072001-A1 Luminescent device CANON KABUSHIKI KAISHA (JP) 2007-03-29 US disclosed