SCHEMBL20180102

SCHEMBL20180102

NC[C@H]1OC(O)[C@@H](O)[C@@H]1O

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ LRAT O95237 2/20 0.37
▸ MEN1 O00255 2/20 0.36
▸ GJA1 P17302 1/20 0.36
▸ GJB2 P29033 1/20 0.36
▸ CYP2C9 P11712 1/20 0.36
▸ TSHR P16473 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ HOGA1 Q86XE5 1/20 0.35
▸ LMNA P02545 1/20 0.35
▸ KDM4E B2RXH2 1/20 0.35
▸ ALOX15 P16050 1/20 0.35
▸ LGALS1 P09382 2/20 0.34
▸ LGALS3 P17931 2/20 0.34
▸ LGALS9 O00182 1/20 0.34
▸ LGALS8 O00214 1/20 0.34
▸ TRPV1 Q8NER1 1/20 0.34
▸ IDUA P35475 1/20 0.33

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
SCHEMBL14150479 1.00 LRAT (0.37) LRATMEN1GJA1GJB2CYP2C9
SCHEMBL13746073 1.00 LRAT (0.37) LRATMEN1GJA1GJB2CYP2C9
SCHEMBL13890067 1.00 LRAT (0.37) LRATMEN1GJA1GJB2CYP2C9
SCHEMBL24265064 1.00 LRAT (0.37) LRATMEN1GJA1GJB2CYP2C9
SCHEMBL15267212 1.00 LRAT (0.37) LRATMEN1GJA1GJB2CYP2C9
SCHEMBL24198606 1.00 LRAT (0.37) LRATMEN1GJA1GJB2CYP2C9
SCHEMBL13852179 0.97 GJA1 (0.38) LRATMEN1GJA1GJB2CYP2C9
SCHEMBL23517631 0.97 GJA1 (0.38) LRATMEN1GJA1GJB2CYP2C9
SCHEMBL21001789 0.97 GJA1 (0.38) LRATMEN1GJA1GJB2CYP2C9
SCHEMBL14113607 0.97 GJA1 (0.38) LRATMEN1GJA1GJB2CYP2C9

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
WO-2022038198-A1 MONOSACCHARIDE COMPOUND FOR THE LABELLING OF CELL SECRETION DIAMIDEX (FR) 2022-02-24 — — WO disclosed
WO-2022008528-A1 METHODS FOR TREATING CANCER USING A MODIFIED MONOSACCHARIDE COMPOUND DIAMIDEX (FR) 2022-01-13 — — WO disclosed
US-20180143200-A1 A METHOD FOR LABELING SPECIFICALLY LIVING MICROORGANISMS COMPRISING THE USE OF MODIFIED MONOSACCHARIDE COMPOUNDS Universite Paris-Saclay (FR) 2018-05-24 — — US disclosed
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