SCHEMBL5308210

SCHEMBL5308210

CC(=O)N[C@H]1[C@@H](OCc2ccccc2)O[C@@H]2COC(C)(C)O[C@H]2[C@@H]1O

nearest known ligand 0.54

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 2/20 0.54
▸ ALDH1A1 P00352 3/20 0.41
▸ MAG P20916 1/20 0.40
▸ PKM P14618 1/20 0.40
▸ POLB P06746 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ HRAS P01112 1/20 0.36
▸ TMEM97 Q5BJF2 1/20 0.36
▸ SIGMAR1 Q99720 1/20 0.36

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
SCHEMBL1836110 1.00 L3MBTL1 (0.54) L3MBTL1ALDH1A1MAGPKMPOLB
SCHEMBL11281689 0.92 L3MBTL1 (0.50) L3MBTL1ALDH1A1MAGPKMPOLB
SCHEMBL15012280 0.91 L3MBTL1 (0.46) L3MBTL1ALDH1A1
SCHEMBL10832365 0.91 L3MBTL1 (0.45) L3MBTL1ALDH1A1MAGPKMTMEM97
SCHEMBL16146024 0.90 L3MBTL1 (0.45) L3MBTL1ALDH1A1MAGPKMTMEM97
SCHEMBL11269209 0.89 L3MBTL1 (0.44) L3MBTL1MAGKMT2A
SCHEMBL8431552 0.86 L3MBTL1 (0.42) L3MBTL1KMT2A
SCHEMBL7644075 0.86 L3MBTL1 (0.42) L3MBTL1ALDH1A1MAGPOLBTMEM97
SCHEMBL10832391 0.85 L3MBTL1 (0.41) L3MBTL1MAGKMT2AHRASTMEM97
SCHEMBL7154934 0.85 MEN1 (0.41) L3MBTL1KMT2ATMEM97SIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007045192-A1 GLUCOSAMINYLMURAMIC ACID DERIVATIVES USTAV ORGANICKE CHEMIE A BIOCHEMIE AKADEMIE VED CESKE REPUBLIKY (CZ) 2007-04-26 — — WO disclosed
US-4314998-A 6-Deoxyglucosamine-peptide derivatives, their production and use TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1982-02-09 — — US disclosed
EP-0015468-A1 6-Deoxyglucosamine-peptide derivatives, their production and use Takeda Chemical Industries, Ltd. (JP) 1980-09-17 — — EP disclosed
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