SCHEMBL7528893

SCHEMBL7528893

O=C(O[C@H]1[C@@H](O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)O[C@H](CO)[C@@H](O)[C@@H]1O)c1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LGALS9 O00182 3/20 0.59
LGALS1 P09382 3/20 0.59
LGALS3 P17931 3/20 0.59
LGALS7; LGALS7B P47929 3/20 0.59
MAOB P27338 1/20 0.54
HSP90AA1 P07900 2/20 0.50
FGF1 P05230 1/20 0.50
FGF2 P09038 1/20 0.50
VEGFA P15692 1/20 0.50
HPSE Q9Y251 1/20 0.50
LGALS8 O00214 1/20 0.48
SELP P16109 3/20 0.47
PTPN1 P18031 1/20 0.47

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
SCHEMBL7528900 0.93 LGALS9 (0.66) LGALS9LGALS1LGALS3LGALS7; LGALS7BMAOB
SCHEMBL16271206 0.89 LGALS3 (0.55) LGALS9LGALS1LGALS3LGALS7; LGALS7BMAOB
SCHEMBL7255474 0.88 LGALS9 (0.52) LGALS9LGALS1LGALS3LGALS7; LGALS7BMAOB
SCHEMBL9451232 0.87 LGALS9 (0.60) LGALS9LGALS1LGALS3LGALS7; LGALS7BMAOB
SCHEMBL8762538 0.87 LGALS9 (0.60) LGALS9LGALS1LGALS3LGALS7; LGALS7BMAOB
SCHEMBL10524702 0.87 LGALS9 (0.60) LGALS9LGALS1LGALS3LGALS7; LGALS7BMAOB
SCHEMBL27777164 0.87 LGALS9 (0.60) LGALS9LGALS1LGALS3LGALS7; LGALS7BMAOB
SCHEMBL18094366 0.87 LGALS9 (0.60) LGALS9LGALS1LGALS3LGALS7; LGALS7BMAOB
SCHEMBL27486746 0.87 LGALS9 (0.60) LGALS9LGALS1LGALS3LGALS7; LGALS7BMAOB
SCHEMBL28090704 0.87 LGALS9 (0.60) LGALS9LGALS1LGALS3LGALS7; LGALS7BMAOB

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0714905-B1 Process for producing trehalose derivatives HAYASHIBARA BIOCHEM LAB (JP) 2002-04-03 EP disclosed
US-5906924-A REACTING ANHYDROUS TREHALOSE UNDER ANHYDROUS CONDITIONS KABUSHIKI KAISHA HAYASHIBARA SEIBUTSU KAGUKU KENKYUJO (JP) 1999-05-25 US disclosed
EP-0714905-A2 Process for producing trehalose derivatives KABUSHIKI KAISHA HAYASHIBARA SEIBUTSU KAGAKU KENKYUJO (JP) 1996-06-05 EP disclosed