SCHEMBL11269209

SCHEMBL11269209

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

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 2/20 0.44
▸ KLK7 P49862 9/20 0.40
▸ KLK5 Q9Y337 8/20 0.40
▸ KMT2A Q03164 2/20 0.38
▸ MEN1 O00255 1/20 0.35
▸ CA12 O43570 1/20 0.34
▸ CA1 P00915 1/20 0.34
▸ CA7 P43166 1/20 0.34
▸ CA14 Q9ULX7 1/20 0.34
▸ CTSL P07711 1/20 0.34
▸ MAG P20916 1/20 0.34

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
SCHEMBL15012280 0.90 L3MBTL1 (0.46) L3MBTL1CA1CTSL
SCHEMBL5308210 0.89 L3MBTL1 (0.54) L3MBTL1KMT2AMAG
SCHEMBL1836110 0.89 L3MBTL1 (0.54) L3MBTL1KMT2AMAG
SCHEMBL16146024 0.86 L3MBTL1 (0.45) L3MBTL1MAG
SCHEMBL10832365 0.85 L3MBTL1 (0.45) L3MBTL1MAG
SCHEMBL8431552 0.82 L3MBTL1 (0.42) L3MBTL1KMT2AMEN1
SCHEMBL16145800 0.81 ALDH1A1 (0.38) L3MBTL1KMT2ACTSL
SCHEMBL7644075 0.81 L3MBTL1 (0.42) L3MBTL1MAG
SCHEMBL11281689 0.81 L3MBTL1 (0.50) L3MBTL1KMT2AMAG
SCHEMBL10832391 0.81 L3MBTL1 (0.41) L3MBTL1KMT2AMEN1MAG

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
EP-0015468-B1 6-DEOXYGLUCOSAMINE-PEPTIDE DERIVATIVES, THEIR PRODUCTION AND USE Takeda Chemical Industries, Ltd. (JP) 1982-12-29 — — EP disclosed
US-4314998-A 6-Deoxyglucosamine-peptide derivatives, their production and use TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1982-02-09 — — US disclosed
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