SCHEMBL5177597

SCHEMBL5177597

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

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 3/20 0.54
▸ KMT2A Q03164 1/20 0.54
▸ ALDH1A1 P00352 3/20 0.51
▸ POLB P06746 2/20 0.51
▸ CYP3A4 P08684 1/20 0.48
▸ MAPT P10636 1/20 0.48
▸ CYP2C9 P11712 1/20 0.48
▸ CYP2C19 P33261 1/20 0.48
▸ CD69 Q07108 1/20 0.46
▸ KDM4E B2RXH2 1/20 0.44
▸ THRB P10828 2/20 0.42
▸ CYP2D6 P10635 1/20 0.42
▸ HSD17B10 Q99714 1/20 0.42
▸ TGM2 P21980 1/20 0.42
▸ LGALS3 P17931 2/20 0.42
▸ LGALS8 O00214 1/20 0.42
▸ LGALS4 P56470 1/20 0.42
▸ MAPK1 P28482 2/20 0.42
▸ CA12 O43570 2/20 0.40
▸ CA1 P00915 2/20 0.40

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
SCHEMBL5177592 1.00 LMNA (0.54) LMNAKMT2AALDH1A1POLBCYP3A4
SCHEMBL31068056 0.90 LMNA (0.64) LMNAKMT2AALDH1A1POLBCYP3A4
SCHEMBL25788683 0.90 LMNA (0.64) LMNAKMT2AALDH1A1POLBCYP3A4
SCHEMBL4399197 0.90 LMNA (0.64) LMNAKMT2AALDH1A1POLBCYP3A4
SCHEMBL25788745 0.90 LMNA (0.64) LMNAKMT2AALDH1A1POLBCYP3A4
SCHEMBL2817867 0.88 LMNA (0.53) LMNAKMT2AALDH1A1POLBCYP3A4
SCHEMBL14400226 0.88 LMNA (0.53) LMNAKMT2AALDH1A1POLBCYP3A4
SCHEMBL12153379 0.88 LMNA (0.53) LMNAKMT2AALDH1A1POLBCYP3A4
SCHEMBL6329776 0.87 LMNA (0.57) LMNAKMT2AALDH1A1POLBCYP3A4
SCHEMBL6329767 0.87 LMNA (0.57) LMNAKMT2AALDH1A1POLBCYP3A4

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-1499743-B1 MEANS AND METHODS FOR DETECTING ENDOGLYCOSIDASE ACTIVITY AZ UNIV AMSTERDAM (NL) 2007-06-06 — — EP disclosed
EP-1359227-A1 Methods for detecting endoglycosidase activity Academisch Ziekenhuis bij de Universiteit van Amsterdam (NL) 2003-11-05 — — EP disclosed
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