SCHEMBL3480269

SCHEMBL3480269

c1cc(OCC2(CC3CO3)CO2)ccc1CC1CO1

nearest known ligand 0.36

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.36
TP53 P04637 4/20 0.35
TSHR P16473 4/20 0.35
ALDH1A1 P00352 4/20 0.35
MAPT P10636 3/20 0.35
HPGD P15428 3/20 0.35
MEN1 O00255 3/20 0.35
KMT2A Q03164 3/20 0.35
HIF1A Q16665 2/20 0.35
PKM P14618 2/20 0.35
CYP1A2 P05177 2/20 0.35
PPARG P37231 1/20 0.35
LMNA P02545 1/20 0.35
GAA P10253 1/20 0.35
CYP3A4 P08684 2/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
ACACB O00763 1/20 0.31
ALOX15 P16050 1/20 0.31
HSD17B10 Q99714 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
SCHEMBL246844 0.83 TDP1 (0.54) TDP1TP53TSHRALDH1A1MEN1
SCHEMBL1352539 0.74 ALDH1A1 (0.38) TDP1TP53TSHRALDH1A1HIF1A
SCHEMBL9247367 0.74 TDP1 (0.63) TDP1TP53TSHRALDH1A1MAPT
SCHEMBL17028666 0.73 TDP1 (0.46) TDP1TP53TSHRALDH1A1MEN1
SCHEMBL1425747 0.71 TDP1 (0.39) TDP1TP53TSHRALDH1A1MAPT
SCHEMBL6305833 0.71 TDP1 (0.39) TDP1TP53TSHRALDH1A1MAPT
SCHEMBL14063027 0.71 TDP1 (0.42) TDP1TP53TSHRALDH1A1MAPT
SCHEMBL131333 0.71 TDP1 (0.38) TDP1TP53TSHRALDH1A1MEN1
SCHEMBL20851114 0.70 TDP1 (0.58) TDP1TP53TSHRALDH1A1MAPT
SCHEMBL27678116 0.70 GAA (0.50) TDP1TP53TSHRALDH1A1MAPT

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8389630-B2 Curable composition KANEKA CORPORATION (JP) 2013-03-05 US disclosed
EP-1970408-B1 CURABLE COMPOSITION KANEKA CORP (JP) 2011-12-28 EP disclosed
US-20100227949-A1 CURABLE COMPOSITION KANEKA CORPORATION (JP) 2010-09-09 US disclosed
EP-1970408-A1 CURABLE COMPOSITION Kaneka Corporation (JP) 2008-09-17 EP disclosed