SCHEMBL11423444

SCHEMBL11423444

CCOC(=O)CCCCCCCCO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1NC(C)=O

nearest known ligand 0.77

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 1/20 0.77
▸ LGALS8 O00214 1/20 0.59
▸ LGALS3 P17931 1/20 0.59
▸ LGALS4 P56470 1/20 0.59
▸ ALDH1A1 P00352 2/20 0.54
▸ THRB P10828 1/20 0.54
▸ MEN1 O00255 1/20 0.52
▸ KMT2A Q03164 1/20 0.52
▸ CA1 P00915 2/20 0.47
▸ CA2 P00918 2/20 0.47
▸ CA9 Q16790 2/20 0.47
▸ CD69 Q07108 1/20 0.47
▸ B4GALT1 P15291 1/20 0.47
▸ SMN1; SMN2 Q16637 1/20 0.46

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
SCHEMBL7148649 1.00 MAPK1 (0.77) MAPK1LGALS8LGALS3LGALS4ALDH1A1
SCHEMBL7148656 1.00 MAPK1 (0.77) MAPK1LGALS8LGALS3LGALS4ALDH1A1
SCHEMBL8831162 0.91 MAPK1 (0.77) MAPK1LGALS8LGALS3LGALS4ALDH1A1
SCHEMBL10488267 0.91 MAPK1 (0.77) MAPK1LGALS8LGALS3LGALS4ALDH1A1
SCHEMBL7148929 0.91 MAPK1 (0.77) MAPK1LGALS8LGALS3LGALS4ALDH1A1
SCHEMBL10488268 0.91 MAPK1 (0.77) MAPK1LGALS8LGALS3LGALS4ALDH1A1
SCHEMBL11423427 0.91 MAPK1 (0.77) MAPK1LGALS8LGALS3LGALS4ALDH1A1
SCHEMBL10488275 0.91 MAPK1 (0.77) MAPK1LGALS8LGALS3LGALS4ALDH1A1
SCHEMBL11423436 0.91 MAPK1 (0.77) MAPK1LGALS8LGALS3LGALS4ALDH1A1
SCHEMBL7148934 0.91 MAPK1 (0.77) MAPK1LGALS8LGALS3LGALS4ALDH1A1

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
US-4238473-A LOWER CARBOHYDRATES HAVING A BRIDGING ARM GLYCOSIDICALLY LINKED TO AN ALDOSE MOIETY CHEMBIOMED LIMITED (CA) 1980-12-09 — — US disclosed
US-4137401-A Glycoside-ether-ester compounds CHEMBIOMED LIMITED (CA) 1979-01-30 — — US disclosed
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