SCHEMBL11848005

SCHEMBL11848005

Cc1cc(C(=O)c2cc(C)sc2C)c(C)s1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.44
MAPT P10636 4/20 0.44
GAA P10253 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
LMNA P02545 2/20 0.44
MAPK1 P28482 1/20 0.44
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
PSMD14 O00487 1/20 0.41
MMP2 P08253 1/20 0.41
ALOX15 P16050 1/20 0.41
HSD17B10 Q99714 1/20 0.41
PLA2G10 O15496 1/20 0.40
GSK3B P49841 1/20 0.39
ALOX5 P09917 1/20 0.39
TSHR P16473 1/20 0.38
KDR P35968 2/20 0.37
KDM4E B2RXH2 1/20 0.37
MEN1 O00255 1/20 0.37
DAO P14920 1/20 0.37

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
SCHEMBL2996683 0.85 ALDH1A1 (0.44) ALDH1A1MAPTGAAL3MBTL1LMNA
SCHEMBL11848129 0.83 ALDH1A1 (0.35) ALDH1A1MAPTGAAL3MBTL1LMNA
SCHEMBL11847449 0.83 DAO (0.52) ALDH1A1MAPTGAAL3MBTL1MAPK1
SCHEMBL287087 0.83 ALDH1A1 (0.57) ALDH1A1MAPTGAAL3MBTL1LMNA
SCHEMBL248005 0.83 SMN1; SMN2 (0.43) ALDH1A1MAPTGAAL3MBTL1LMNA
SCHEMBL11851529 0.82 ALDH1A1 (0.56) ALDH1A1MAPTGAAL3MBTL1LMNA
SCHEMBL13230151 0.82 MAPT (0.70) ALDH1A1MAPTGAAL3MBTL1LMNA
SCHEMBL11845297 0.81 ALDH1A1 (0.41) ALDH1A1MAPTGAAL3MBTL1LMNA
SCHEMBL17367390 0.81 PLA2G10 (0.49) ALDH1A1MAPTGAAL3MBTL1LMNA
SCHEMBL11728556 0.79 ALDH1A1 (0.44) ALDH1A1MAPTGAAL3MBTL1LMNA

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-3983244-A Method of controlling pests using certain ketones of furan UNIROYAL INC. (US) 1976-09-28 US disclosed