SCHEMBL7916070

SCHEMBL7916070

C[C@@H]1OC(Sc2ccccc2)[C@@H](OC(=O)C(C)(C)C)[C@H](OC(=O)C(C)(C)C)[C@@H]1OC(=O)C(C)(C)C

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ CA12 O43570 3/20 0.39
▸ CA1 P00915 3/20 0.39
▸ CA2 P00918 3/20 0.39
▸ CA4 P22748 3/20 0.39
▸ CA5A P35218 3/20 0.39
▸ CA7 P43166 3/20 0.39
▸ CA5B Q9Y2D0 3/20 0.39
▸ ELANE P08246 3/20 0.32
▸ GAA P10253 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ FKBP1A P62942 1/20 0.31
▸ L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL8009738 1.00 CA12 (0.39) CA12CA1CA2CA4CA5A
SCHEMBL14601945 0.88 LGALS9 (0.37) CA12CA1CA2CA4CA5A
SCHEMBL17309270 0.85 CA12 (0.49) CA12CA1CA2CA4CA5A
SCHEMBL7905808 0.85 CA12 (0.49) CA12CA1CA2CA4CA5A
SCHEMBL582508 0.85 CA12 (0.49) CA12CA1CA2CA4CA5A
SCHEMBL13775041 0.85 CA12 (0.49) CA12CA1CA2CA4CA5A
SCHEMBL14571449 0.85 CA12 (0.49) CA12CA1CA2CA4CA5A
SCHEMBL19090190 0.85 CA12 (0.49) CA12CA1CA2CA4CA5A
SCHEMBL18324625 0.85 CA12 (0.49) CA12CA1CA2CA4CA5A
SCHEMBL7455747 0.82 CA12 (0.53) CA12CA1CA2CA4CA5A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6274716-B1 COMPRISE DISACCHARIDES AND TRISACCHARIDES COVALENTLY BONDED TO LIPID OR LIPID MIMETIC THROUGH PHOSPHOROUS LINKAGE; SCREENED FOR ANTI-MICROBIAL ACTIVITY BY CONTACTING THEM WITH CULTURE OF MICROBES AND MONITORING THE GROWTH RATE ADVANCED MEDICINE, INC. 2001-08-14 — — US disclosed
US-6207820-B1 SOLID PHASE SYNTHESIS BY LINKING ACCEPTOR MONOSACCHARIDE TO SUPPORT FORMING CARBOXYLATE OR CARBOXYAMIDE LINKAGE, COVALENTLY LINKING DONOR SACCHARIDE BY O-GLYCOSIDIC LINKAGE, COUPLING LIPOPHOSPHOGLYCERATE MIMETIC, CLEAVING FROM SUPPORT INCARA RESEARCH LABORATORIES 2001-03-27 — — US disclosed
EP-1047703-A1 A COMBINATORIAL LIBRARY OF MOENOMYCIN ANALOGS AND METHODS OF PRODUCING SAME Incara Pharmaceutical Corp. (US) 2000-11-02 — — EP disclosed
US-6114309-A REACTION PRODUCT OF MONOSACCHARIDE, DISACCHARIDE AND LIPOPHOSPHOGLYCERATE MINETIC INCARA RESEARCH LABORATORIES (US) 2000-09-05 — — US disclosed
WO-1999026956-A1 A COMBINATORIAL LIBRARY OF MOENOMYCIN ANALOGS AND METHODS OF PRODUCING SAME INCARA PHARMACEUTICAL CORP. (US) 1999-06-03 — — WO disclosed
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