SCHEMBL17173997

SCHEMBL17173997

CC1O[C@@H](O[C@@H]2C(O)[C@H](OCc3ccccc3)OC(CO)[C@H]2O[C@@H]2O[C@@H](CO)[C@@H]3OC(C)(C)OC3C2O)C(OCc2ccccc2)[C@@H](OCc2ccccc2)[C@@H]1C

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 1/20 0.43
MAG P20916 1/20 0.37
LGALS8 O00214 1/20 0.37
L3MBTL1 Q9Y468 2/20 0.35
PRKCA P17252 2/20 0.35
KDM1A O60341 1/20 0.35
BACE1 P56817 1/20 0.35
FGF1 P05230 2/20 0.35
FGF2 P09038 2/20 0.35
VEGFA P15692 2/20 0.35
HPSE Q9Y251 2/20 0.35
SELP P16109 3/20 0.35
SELL P14151 2/20 0.35
LGALS3 P17931 2/20 0.34
HRAS P01112 1/20 0.34

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
SCHEMBL17173994 0.86 SLC6A2 (0.52) SLC6A2LGALS8L3MBTL1PRKCAKDM1A
SCHEMBL19658823 0.85 SLC6A2 (0.45) SLC6A2MAGLGALS8LGALS3HRAS
SCHEMBL19652045 0.85 SLC6A2 (0.45) SLC6A2MAGLGALS8LGALS3HRAS
SCHEMBL7154227 0.83 SLC6A2 (0.44) SLC6A2LGALS8
SCHEMBL7642620 0.83 SLC6A2 (0.44) SLC6A2LGALS8
SCHEMBL9073779 0.81 ALDH1A1 (0.48) SLC6A2FGF1FGF2VEGFAHPSE
SCHEMBL8741450 0.81 ALDH1A1 (0.48) SLC6A2FGF1FGF2VEGFAHPSE
SCHEMBL18570422 0.80 SLC6A2 (0.53) SLC6A2LGALS8L3MBTL1PRKCAKDM1A
SCHEMBL19669777 0.80 SLC6A2 (0.53) SLC6A2LGALS8L3MBTL1PRKCAKDM1A
SCHEMBL19652050 0.78 SLC6A2 (0.53) SLC6A2LGALS8L3MBTL1PRKCAKDM1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9834574-B2 Crystalline 3-O-fucosyllactose GLYCOM A/S (DK) 2017-12-05 US disclosed
US-20150291642-A1 CRYSTALLINE 3-O-FUCOSYLLACTOSE GLYCOM A/S (DK) 2015-10-15 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20150291642-A1 CRYSTALLINE 3-O-FUCOSYLLACTOSE FUCA2, FUT6, FUCA1 SLC6A2 2365/4885MAG 748/4885LGALS8 194/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.