SCHEMBL26977549

SCHEMBL26977549

CO[C@@H]1[C@@H](n2cc(-c3cc(F)c(F)c(F)c3)nn2)[C@@H](O)[C@@H](CO)O[C@@H]1Cc1cc(C)no1

nearest known ligand 0.57

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ LGALS3 P17931 20/20 0.57
▸ LGALS1 P09382 2/20 0.56

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
SCHEMBL30819236 0.90 LGALS3 (0.56) LGALS3LGALS1
SCHEMBL23041762 0.90 LGALS3 (0.59) LGALS3LGALS1
SCHEMBL23041754 0.90 LGALS3 (0.55) LGALS3LGALS1
SCHEMBL26977618 0.89 LGALS3 (0.54) LGALS3LGALS1
SCHEMBL23041713 0.88 LGALS3 (0.54) LGALS3LGALS1
SCHEMBL23041839 0.88 LGALS3 (0.54) LGALS3LGALS1
SCHEMBL26977327 0.88 LGALS3 (0.60) LGALS3LGALS1
SCHEMBL23042418 0.87 LGALS3 (0.53) LGALS3LGALS1
SCHEMBL23041984 0.87 LGALS3 (0.53) LGALS3LGALS1
SCHEMBL26977412 0.87 LGALS3 (0.61) LGALS3LGALS1

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-4021904-B1 ALPHA-D-GALACTOPYRANOSIDE DERIVATIVES IDORSIA PHARMACEUTICALS LTD (CH) 2024-01-03 — — EP disclosed
Send feedback