SCHEMBL23924531

SCHEMBL23924531

C=C(C)C(=O)O[C@@H]1[C@@H](O)[C@@H](O)O[C@H](CO)[C@H]1O

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ LGALS8 O00214 10/20 0.48
▸ MAPK1 P28482 1/20 0.43
▸ SLC2A1 P11166 1/20 0.41
▸ LGALS9 O00182 4/20 0.39
▸ LGALS1 P09382 4/20 0.39
▸ LGALS3 P17931 4/20 0.39
▸ LGALS7; LGALS7B P47929 3/20 0.38
▸ PYGB P11216 1/20 0.36
▸ CD69 Q07108 1/20 0.36
▸ KDM4E B2RXH2 1/20 0.35
▸ LMNA P02545 1/20 0.35
▸ CYP2D6 P10635 1/20 0.35
▸ CYP2C19 P33261 1/20 0.35
▸ SLC28A3 Q9HAS3 1/20 0.35

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
SCHEMBL2492337 0.86 LGALS8 (0.43) LGALS8MAPK1SLC2A1LGALS9LGALS1
SCHEMBL19619517 0.86 LGALS8 (0.39) LGALS8MAPK1SLC2A1LGALS9LGALS1
SCHEMBL10865539 0.85 LGALS8 (0.48) LGALS8LGALS3
SCHEMBL17965604 0.83 LGALS8 (0.41) LGALS8MAPK1LGALS9LGALS1LGALS3
SCHEMBL12427215 0.83 LGALS8 (0.49) LGALS8MAPK1SLC2A1LGALS9LGALS1
SCHEMBL2489960 0.82 LGALS8 (0.42) LGALS8MAPK1LGALS9LGALS1LGALS3
SCHEMBL21924095 0.82 LGALS8 (0.42) LGALS8MAPK1LGALS9LGALS1LGALS3
SCHEMBL15441203 0.82 LGALS8 (0.42) LGALS8MAPK1LGALS9LGALS1LGALS3
SCHEMBL15441204 0.82 LGALS8 (0.41) LGALS8MAPK1LGALS9LGALS1LGALS3
SCHEMBL19176297 0.82 LGALS8 (0.50) LGALS8LGALS9LGALS1LGALS3LGALS7; LGALS7B

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-20210323066-A1 MATERIAL SETS HEWLETT-PACKARD DEVELOPMENT COMPANY, L.P. 2021-10-21 — — US claimed
US-20210323066-A1 MATERIAL SETS HEWLETT-PACKARD DEVELOPMENT COMPANY, L.P. 2021-10-21 — — US disclosed
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