SCHEMBL2829370

SCHEMBL2829370

CC(OCOC(C)OCC1CO1)OCC1CO1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.41
TSHR P16473 5/20 0.39
MAPK1 P28482 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.38
TDP1 Q9NUW8 2/20 0.35
GLA P06280 1/20 0.33
TP53 P04637 4/20 0.32
MAPT P10636 2/20 0.32
HPGD P15428 2/20 0.32
HIF1A Q16665 2/20 0.32
MEN1 O00255 1/20 0.32
CYP1A2 P05177 1/20 0.32
KMT2A Q03164 1/20 0.32
PPARG P37231 1/20 0.32
CYP3A4 P08684 2/20 0.31
LMNA P02545 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
SCHEMBL635723 0.93 ALDH1A1 (0.46) ALDH1A1TSHRMAPK1SMN1; SMN2TDP1
SCHEMBL2835026 0.86 TSHR (0.43) ALDH1A1TSHRMAPK1SMN1; SMN2TDP1
SCHEMBL812022 0.84 LMNA (0.52) ALDH1A1TSHRMAPK1SMN1; SMN2TDP1
SCHEMBL25250896 0.84 LMNA (0.52) ALDH1A1TSHRMAPK1SMN1; SMN2TDP1
SCHEMBL25247908 0.84 LMNA (0.52) ALDH1A1TSHRMAPK1SMN1; SMN2TDP1
SCHEMBL24858079 0.83 TSHR (0.40) ALDH1A1TSHRMAPK1SMN1; SMN2TDP1
SCHEMBL12526218 0.83 TSHR (0.40) ALDH1A1TSHRMAPK1SMN1; SMN2TDP1
SCHEMBL539146 0.82
SCHEMBL19543498 0.81 SMN1; SMN2 (0.47) ALDH1A1TSHRMAPK1SMN1; SMN2TDP1
SCHEMBL21856241 0.81 TSHR (0.39) ALDH1A1TSHRMAPK1SMN1; SMN2TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100160555-A1 RESIN COMPOSITION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-06-24 US disclosed
EP-2133380-A1 RESIN COMPOSITION Sumitomo Chemical Company, Limited (JP) 2009-12-16 EP disclosed