SCHEMBL13560177

SCHEMBL13560177

CO[C@@H]1OC(C(=O)O)[C@@H](O)C(O[C@@H]2O[C@@H](CO)C(O)C2O)C1O[C@@H]1OC(CO)[C@H](O)C(O)C1O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LGALS3 P17931 3/20 0.47
▸ LGALS9 O00182 1/20 0.47
▸ LGALS1 P09382 1/20 0.47
▸ LGALS7; LGALS7B P47929 1/20 0.47
▸ LGALS8 O00214 4/20 0.46
▸ IGF2R P11717 1/20 0.45
▸ MEN1 O00255 2/20 0.44
▸ KMT2A Q03164 2/20 0.44
▸ FGF1 P05230 2/20 0.43
▸ L3MBTL1 Q9Y468 1/20 0.42
▸ LGALS4 P56470 2/20 0.41
▸ PTPN1 P18031 1/20 0.40
▸ GJA1 P17302 1/20 0.40
▸ GJB2 P29033 1/20 0.40
▸ KDM4E B2RXH2 1/20 0.40
▸ POLB P06746 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ CYP2C9 P11712 1/20 0.40
▸ TSHR P16473 1/20 0.40
▸ ALDH1A1 P00352 1/20 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
SCHEMBL13560166 1.00 LGALS3 (0.47) LGALS3LGALS9LGALS1LGALS7; LGALS7BLGALS8
SCHEMBL13559835 1.00 LGALS3 (0.47) LGALS3LGALS9LGALS1LGALS7; LGALS7BLGALS8
SCHEMBL13559836 1.00 LGALS3 (0.47) LGALS3LGALS9LGALS1LGALS7; LGALS7BLGALS8
SCHEMBL13867741 1.00 LGALS3 (0.47) LGALS3LGALS9LGALS1LGALS7; LGALS7BLGALS8
SCHEMBL13288201 1.00 LGALS3 (0.47) LGALS3LGALS9LGALS1LGALS7; LGALS7BLGALS8
SCHEMBL14255515 1.00 LGALS3 (0.47) LGALS3LGALS9LGALS1LGALS7; LGALS7BLGALS8
SCHEMBL10014359 0.92 IGF2R (0.50) LGALS3LGALS9LGALS1LGALS7; LGALS7BLGALS8
SCHEMBL10014356 0.92 LGALS8 (0.52) LGALS3LGALS9LGALS1LGALS7; LGALS7BLGALS8
SCHEMBL22030544 0.91 FGF1 (0.47) LGALS3LGALS9LGALS1LGALS7; LGALS7BLGALS8
SCHEMBL10014358 0.91 FGF1 (0.47) LGALS3LGALS9LGALS1LGALS7; LGALS7BLGALS8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7514412-B2 Anticancer biangeloyl saponins PACIFIC ARROW LIMITED (CN) 2009-04-07 — — US disclosed
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