SCHEMBL18608226

SCHEMBL18608226

CO[C@@H]1C(C(=O)O)O[C@@H](OC2[C@@H](O)C(CO)O[C@@H](C(C)(C)C)[C@H]2NC(C)=O)C(O)[C@H]1O

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ LGALS3 P17931 6/20 0.43
▸ LGALS8 O00214 2/20 0.43
▸ MAPK1 P28482 2/20 0.43
▸ LGALS4 P56470 1/20 0.43
▸ MDK P21741 3/20 0.42
▸ BDNF P23560 3/20 0.42
▸ PTN P21246 2/20 0.42
▸ CD69 Q07108 1/20 0.40
▸ LGALS1 P09382 1/20 0.40
▸ LGALS7; LGALS7B P47929 1/20 0.40
▸ LGALS9 O00182 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ THRB P10828 1/20 0.39
▸ F10 P00742 1/20 0.37

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
SCHEMBL23322444 1.00 LGALS3 (0.43) LGALS3LGALS8MAPK1LGALS4MDK
SCHEMBL18608138 1.00 LGALS3 (0.43) LGALS3LGALS8MAPK1LGALS4MDK
SCHEMBL19325099 0.91 LGALS3 (0.43) LGALS3LGALS8MAPK1LGALS4MDK
SCHEMBL18936352 0.91 LGALS3 (0.43) LGALS3LGALS8MAPK1LGALS4MDK
SCHEMBL22137175 0.91 LGALS3 (0.42) LGALS3LGALS8MAPK1LGALS4MDK
SCHEMBL20021737 0.90 LGALS3 (0.47) LGALS3LGALS8MAPK1LGALS4MDK
SCHEMBL19818421 0.90 BDNF (0.42) LGALS3LGALS8MAPK1LGALS4MDK
Dermatan SCHEMBL12691925 0.88 LGALS3 (0.49) LGALS3LGALS8MAPK1LGALS4MDK
Dermatan SCHEMBL13472480 0.88 LGALS3 (0.49) LGALS3LGALS8MAPK1LGALS4MDK
Dermatan SCHEMBL19846466 0.88 LGALS3 (0.49) LGALS3LGALS8MAPK1LGALS4MDK

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-20170067012-A1 HYALURONIC ACID DERIVATIVES AND COMPOSITION FOR CELL-SURFACE ENGINEERING USING THE SAME POSTECH ACADEMY-INDUSTRY FOUNDATION (KR) 2017-03-09 — — US disclosed
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