SCHEMBL3465804

SCHEMBL3465804

Cc1cc(-c2ccc3c(c2)-c2ccccc2C3c2ccc(O)c(C)c2)ccc1O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B1 P14061 7/20 0.46
HSD17B2 P37059 7/20 0.46
ESR2 Q92731 2/20 0.45
TLR8 Q9NR97 1/20 0.43
CYP3A4 P08684 2/20 0.38
CYP2D6 P10635 2/20 0.38
CYP2C19 P33261 2/20 0.38
TYMS P04818 1/20 0.37
ESR1 P03372 1/20 0.37
MEN1 O00255 1/20 0.37
GAA P10253 1/20 0.37
KMT2A Q03164 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
MCL1 Q07820 1/20 0.35
EDNRB P24530 2/20 0.35
EDNRA P25101 2/20 0.35
PIM1 P11309 1/20 0.35
APP P05067 1/20 0.35
PDE10A Q9Y233 1/20 0.35
FGFR1 P11362 1/20 0.35

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
SCHEMBL918079 0.89 ESR1 (0.44) HSD17B1HSD17B2ESR2TLR8CYP3A4
SCHEMBL5717482 0.86 TLR8 (0.44) HSD17B1HSD17B2ESR2TLR8CYP3A4
SCHEMBL2480900 0.80 RARB (0.39) HSD17B1HSD17B2ESR2ESR1MEN1
SCHEMBL15062364 0.77 MEN1 (0.47) HSD17B1HSD17B2ESR2CYP3A4ESR1
SCHEMBL5792232 0.73 PTGS1 (0.40) L3MBTL1
SCHEMBL29562188 0.73 MAOA (0.43) ESR2CYP3A4ESR1MEN1GAA
SCHEMBL29562117 0.73 PDE10A (0.39) HSD17B1HSD17B2ESR2CYP3A4CYP2D6
SCHEMBL3366833 0.72 BACE1 (0.50) HSD17B1HSD17B2CYP3A4CYP2C19MEN1
SCHEMBL5679835 0.72 ALDH1A1 (0.42) CYP3A4MEN1GAAKMT2AL3MBTL1
SCHEMBL4640231 0.72 ALDH1A1 (0.44) MEN1GAAKMT2AL3MBTL1MCL1

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-2211356-A1 TRANSPARENT CONDUCTIVE LAMINATE AND TRANSPARENT TOUCH PANEL Teijin Limited (JP) 2010-07-28 EP disclosed