SCHEMBL15083009

SCHEMBL15083009

CC(=O)OCC1OC(OC(C)=O)C(OC(C)=O)C(OC(C)=O)C1OC1OC2COC(c3ccccc3)OC2C(OC(C)=O)C1OC(C)=O

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 1/20 0.52
▸ L3MBTL1 Q9Y468 2/20 0.47
▸ PRKCA P17252 1/20 0.47
▸ AKT1 P31749 1/20 0.47
▸ PTK2 Q05397 1/20 0.47
▸ LMNA P02545 1/20 0.46
▸ PAX8 Q06710 1/20 0.45
▸ MEN1 O00255 1/20 0.44
▸ KMT2A Q03164 1/20 0.44
▸ CA1 P00915 9/20 0.43
▸ CA2 P00918 9/20 0.43
▸ CA9 Q16790 9/20 0.43
▸ CA12 O43570 8/20 0.42
▸ CA14 Q9ULX7 2/20 0.41

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
SCHEMBL23591488 0.94 TSHR (0.56) TSHRL3MBTL1PRKCAAKT1PTK2
SCHEMBL16189505 0.91 L3MBTL1 (0.48) TSHRL3MBTL1PRKCAAKT1PTK2
SCHEMBL17955876 0.88 L3MBTL1 (0.46) TSHRL3MBTL1PRKCAAKT1PTK2
SCHEMBL25503494 0.86 L3MBTL1 (0.60) TSHRL3MBTL1LMNAMEN1KMT2A
SCHEMBL25503299 0.86 L3MBTL1 (0.60) TSHRL3MBTL1LMNAMEN1KMT2A
SCHEMBL25503290 0.86 L3MBTL1 (0.60) TSHRL3MBTL1LMNAMEN1KMT2A
SCHEMBL7563649 0.86 L3MBTL1 (0.60) TSHRL3MBTL1LMNAMEN1KMT2A
SCHEMBL28635604 0.86 L3MBTL1 (0.51) TSHRL3MBTL1PRKCAAKT1PTK2
SCHEMBL796260 0.85 TSHR (0.46) TSHRL3MBTL1PRKCAAKT1PTK2
SCHEMBL16715898 0.85 KMT2A (0.55) TSHRL3MBTL1PRKCAAKT1PTK2

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-2610262-A1 6'-sialyllactose salts and process for their synthesis and for the synthesis of other A-sialyloligosaccharides Inalco S.p.A. (IT) 2013-07-03 — — EP disclosed
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