SCHEMBL31572016

SCHEMBL31572016

O=C(O)c1ccccc1N(C1O[C@H](CO)[C@@H](O)[C@H]1O)P(=O)(O)O

nearest known ligand 0.40

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MMP12 P39900 1/20 0.39
HK1 P19367 2/20 0.38
HK2 P52789 2/20 0.38
LGALS9 O00182 1/20 0.36
LGALS1 P09382 1/20 0.36
LGALS3 P17931 1/20 0.36
LGALS7; LGALS7B P47929 1/20 0.36
HRAS P01112 1/20 0.36

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
SCHEMBL29690112 0.82 MMP12 (0.41) MMP12HK1HK2LGALS9LGALS1
SCHEMBL3290451 0.68 SLC5A2 (0.53)
SCHEMBL27566400 0.67 LGALS1 (0.38) LGALS9LGALS1LGALS3
SCHEMBL29804069 0.67 ALDH1A1 (0.44)
SCHEMBL28424736 0.67 ALDH1A1 (0.44)
SCHEMBL263893 0.67 CDA (0.34) LGALS1LGALS3
Phosphoric Acid SCHEMBL27486572 0.67 SLC5A2 (0.40) HK1HK2
SCHEMBL7459111 0.66 SLC5A2 (0.51)
SCHEMBL28315414 0.66 MMP12 (0.33) MMP12HK1HK2LGALS9LGALS1
SCHEMBL31180739 0.66 HK1 (0.67) HK1HK2LGALS9LGALS1LGALS3

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
WO-2025089419-A1 METHOD FOR TRANSFORMING FILAMENTOUS FUNGUS キッコーマン株式会社 2025-05-01 WO disclosed