SCHEMBL10947656

SCHEMBL10947656

COC(=O)C(C)O[C@@H]1[C@@H](NC(C)=O)[C@@H](OCc2ccccc2)O[C@@H]2COC(C)(C)O[C@@H]12

nearest known ligand 0.52

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 2/20 0.52
▸ POLB P06746 1/20 0.38
▸ MAG P20916 1/20 0.38
▸ LMNA P02545 3/20 0.35
▸ KMT2A Q03164 2/20 0.35
▸ CYP1A2 P05177 4/20 0.35
▸ CYP3A4 P08684 4/20 0.35
▸ CYP2C9 P11712 4/20 0.35
▸ CYP2C19 P33261 4/20 0.35
▸ TSHR P16473 3/20 0.35
▸ SMN1; SMN2 Q16637 2/20 0.35
▸ ALDH1A1 P00352 2/20 0.35
▸ MEN1 O00255 1/20 0.35
▸ MAPK1 P28482 1/20 0.35
▸ HSD17B10 Q99714 1/20 0.35
▸ BCHE P06276 1/20 0.34
▸ GSTP1 P09211 2/20 0.33
▸ CYP2D6 P10635 2/20 0.32
▸ HCRTR2 O43614 1/20 0.32

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
SCHEMBL9473154 0.93 L3MBTL1 (0.53) L3MBTL1POLBMAGLMNAKMT2A
SCHEMBL11123573 0.86 L3MBTL1 (0.51) L3MBTL1POLBMAGLMNAKMT2A
SCHEMBL10881195 0.85 L3MBTL1 (0.36) L3MBTL1MAGLMNAKMT2AALDH1A1
SCHEMBL10832730 0.85 L3MBTL1 (0.61) L3MBTL1POLBMAGLMNAKMT2A
SCHEMBL22607623 0.84 L3MBTL1 (0.74) L3MBTL1POLBMAGLMNAKMT2A
SCHEMBL14612249 0.84 L3MBTL1 (0.74) L3MBTL1POLBMAGLMNAKMT2A
SCHEMBL11599050 0.84 L3MBTL1 (0.74) L3MBTL1POLBMAGLMNAKMT2A
SCHEMBL14410823 0.84 L3MBTL1 (0.74) L3MBTL1POLBMAGLMNAKMT2A
SCHEMBL5308210 0.83 L3MBTL1 (0.54) L3MBTL1POLBMAGKMT2AALDH1A1
SCHEMBL1836110 0.83 L3MBTL1 (0.54) L3MBTL1POLBMAGKMT2AALDH1A1

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-4606857-A MICROBIOCIDES AND ANTITUMOR AGENTS DAIICHI SEIYAKU CO., LTD. (JP) 1986-08-19 — — US disclosed
EP-0100104-B1 MURAMYLDIPEPTIDE DERIVATIVES DAIICHI SEIYAKU CO., LTD. (JP) 1986-01-29 — — EP disclosed
Send feedback