SCHEMBL26103746

SCHEMBL26103746

O=C(N[C@H]1[C@H](OCc2ccccc2)O[C@H](CO)[C@@H](O)[C@@H]1O)OCC(Cl)(Cl)Cl

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LGALS8 O00214 1/20 0.44
▸ SLC6A2 P23975 1/20 0.42
▸ SYNJ2 O15056 2/20 0.41
▸ POLB P06746 2/20 0.41
▸ KDM4E B2RXH2 1/20 0.41
▸ ABL1 P00519 1/20 0.41
▸ ALPL P05186 1/20 0.41
▸ ALPI P09923 1/20 0.41
▸ GAA P10253 1/20 0.41
▸ MAPT P10636 1/20 0.41
▸ ALPG P10696 1/20 0.41
▸ PABPC1 P11940 1/20 0.41
▸ RECQL P46063 1/20 0.41
▸ GALK1 P51570 1/20 0.41
▸ CASP7 P55210 1/20 0.41
▸ CASP6 P55212 1/20 0.41
▸ MCL1 Q07820 1/20 0.41
▸ RIN1 Q13671 1/20 0.41
▸ EIF4H Q15056 1/20 0.41
▸ CA1 P00915 1/20 0.41

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
SCHEMBL16218793 1.00 LGALS8 (0.44) LGALS8SLC6A2SYNJ2POLBKDM4E
SCHEMBL2307255 1.00 LGALS8 (0.44) LGALS8SLC6A2SYNJ2POLBKDM4E
SCHEMBL2307262 1.00 LGALS8 (0.44) LGALS8SLC6A2SYNJ2POLBKDM4E
SCHEMBL2311527 0.92 LGALS8 (0.47) LGALS8SLC6A2
SCHEMBL2311523 0.92 LGALS8 (0.47) LGALS8SLC6A2
SCHEMBL7768969 0.89 LGALS8 (0.51) LGALS8SLC6A2SYNJ2POLBKDM4E
SCHEMBL14376669 0.88 LGALS8 (0.42) LGALS8CA1CA2CA9MEN1
SCHEMBL14376670 0.87 LGALS8 (0.40) LGALS8CA1CA2CA9MEN1
SCHEMBL15501143 0.87 ANPEP (0.38) LGALS8SYNJ2POLBKDM4EABL1
SCHEMBL2003090 0.87 ANPEP (0.38) LGALS8SYNJ2POLBKDM4EABL1

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-2023074843-A1 NOVEL OLIGOSACCHARIDE, MANUFACTURING INTERMEDIATE FOR NOVEL OLIGOSACCHARIDE, AND METHOD FOR MANUFACTURING THESE 第一三共株式会社 2023-05-04 — — WO disclosed
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