SCHEMBL13049236

SCHEMBL13049236

CC(=O)NC1[C@H](OC[C@H](N)C(=O)O)OC(COC(C)=O)[C@@H](OC(C)=O)[C@H]1OC(C)=O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 3/20 0.57
▸ KMT2A Q03164 1/20 0.57
▸ POLB P06746 2/20 0.55
▸ ALDH1A1 P00352 2/20 0.53
▸ CYP3A4 P08684 1/20 0.52
▸ MAPT P10636 1/20 0.52
▸ CYP2C9 P11712 1/20 0.52
▸ CYP2C19 P33261 1/20 0.52
▸ KDM4E B2RXH2 1/20 0.47
▸ CYP2D6 P10635 1/20 0.45
▸ THRB P10828 1/20 0.45
▸ HSD17B10 Q99714 1/20 0.45
▸ MMP12 P39900 1/20 0.45
▸ CA2 P00918 9/20 0.43
▸ CA9 Q16790 7/20 0.43
▸ CA12 O43570 7/20 0.43
▸ CA1 P00915 7/20 0.43
▸ TSHR P16473 1/20 0.41
▸ TGM2 P21980 1/20 0.40
▸ CA4 P22748 1/20 0.39

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
SCHEMBL1371517 1.00 LMNA (0.57) LMNAKMT2APOLBALDH1A1CYP3A4
SCHEMBL13542061 1.00 LMNA (0.57) LMNAKMT2APOLBALDH1A1CYP3A4
SCHEMBL1371518 1.00 LMNA (0.57) LMNAKMT2APOLBALDH1A1CYP3A4
SCHEMBL14031258 1.00 LMNA (0.57) LMNAKMT2APOLBALDH1A1CYP3A4
SCHEMBL13029576 1.00 LMNA (0.57) LMNAKMT2APOLBALDH1A1CYP3A4
SCHEMBL6272209 0.86 CYP2D6 (0.56) MAPTCYP2D6THRBHSD17B10CA2
SCHEMBL14019274 0.86 CYP2D6 (0.56) MAPTCYP2D6THRBHSD17B10CA2
SCHEMBL5570985 0.86 CYP2D6 (0.56) MAPTCYP2D6THRBHSD17B10CA2
SCHEMBL17969688 0.86 LMNA (0.57) LMNAKMT2APOLBALDH1A1CYP3A4
SCHEMBL17230115 0.84 POLB (0.54) LMNAKMT2APOLBALDH1A1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7834159-B2 Pharmacokinetics; glycosyltransferases; vaccines THE SCRIPPS RESEARCH INSTITUTE (US) 2010-11-16 — — US disclosed
US-20100009425-A1 Glycoprotein synthesis THE SCRIPPS RESEARCH INSTITUTE (US) 2010-01-14 — — US disclosed
US-20080064059-A1 In Vivo Site-Specific Incorporation of N-Acetyl-Galactosamine Amino Acids in Eubacteria SCRIPPS RESEARCH INSTITUTE 2008-03-13 — — US disclosed
US-7262040-B2 Glycoprotein synthesis THE SCRIPPS RESEARCH INSTITUTE (US) 2007-08-28 — — US disclosed
US-20070172915-A1 Glycoprotein synthesis THE SCRIPPS RESEARCH INSTITUTE (US) 2007-07-26 — — US disclosed
US-7183082-B2 Glycoprotein synthesis THE SCRIPPS RESEARCH INSTITUTE (US) 2007-02-27 — — US disclosed
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