SCHEMBL19675783

SCHEMBL19675783

CC(=O)NC1C(O[C@@H]2OC(C(=O)O)[C@@H](C)C(O)C2O)C(O)C(CO)O[C@H]1O

nearest known ligand 0.57

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 2/20 0.57
▸ LGALS3 P17931 6/20 0.48
▸ LGALS8 O00214 1/20 0.45
▸ LGALS4 P56470 1/20 0.45
▸ CD69 Q07108 1/20 0.43
▸ NOD2 Q9HC29 1/20 0.42
▸ ALDH1A1 P00352 1/20 0.41
▸ THRB P10828 1/20 0.41
▸ CHIA Q9BZP6 1/20 0.39
▸ MDK P21741 2/20 0.39
▸ PTN P21246 1/20 0.39
▸ BDNF P23560 1/20 0.39
▸ LGALS1 P09382 1/20 0.38
▸ LGALS7; LGALS7B P47929 1/20 0.38
▸ LGALS9 O00182 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
SCHEMBL18376688 1.00 MAPK1 (0.57) MAPK1LGALS3LGALS8LGALS4CD69
SCHEMBL12009749 0.91 MAPK1 (0.46) MAPK1LGALS3LGALS8LGALS4CD69
SCHEMBL29533003 0.91 MAPK1 (0.59) MAPK1LGALS3LGALS8LGALS4CD69
SCHEMBL19864355 0.91 MAPK1 (0.59) MAPK1LGALS3LGALS8LGALS4CD69
SCHEMBL30055691 0.91 MAPK1 (0.59) MAPK1LGALS3LGALS8LGALS4CD69
SCHEMBL12878533 0.91 MAPK1 (0.59) MAPK1LGALS3LGALS8LGALS4CD69
SCHEMBL8062325 0.91 MAPK1 (0.59) MAPK1LGALS3LGALS8LGALS4CD69
SCHEMBL29472159 0.91 MAPK1 (0.59) MAPK1LGALS3LGALS8LGALS4CD69
SCHEMBL11965622 0.89 LGALS3 (0.49) MAPK1LGALS3LGALS8LGALS4CD69
SCHEMBL25768039 0.89 LGALS3 (0.49) MAPK1LGALS3LGALS8LGALS4CD69

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
EP-3252081-A1 HYDROLYSIS OF ESTER BONDS IN AMIDE CROSSLINKED GLYCOSAMINOGLYCANS Galderma S.A. (CH) 2017-12-06 — — EP disclosed
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