SCHEMBL16153926

SCHEMBL16153926

CC1(C)OCC2O[C@@H](OCc3ccccc3)C(N)[C@@H](O[C@@H]3OC(CO)[C@H](O)[C@H](O)C3O)[C@@H]2O1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SLC6A2 P23975 2/20 0.47
▸ GJB2 P29033 5/20 0.44
▸ HRAS P01112 1/20 0.41
▸ MAG P20916 1/20 0.40
▸ GJA1 P17302 4/20 0.39
▸ SYNJ2 O15056 2/20 0.38
▸ KDM4E B2RXH2 1/20 0.38
▸ ABL1 P00519 1/20 0.38
▸ ALPL P05186 1/20 0.38
▸ POLB P06746 1/20 0.38
▸ ALPI P09923 1/20 0.38
▸ GAA P10253 1/20 0.38
▸ MAPT P10636 1/20 0.38
▸ ALPG P10696 1/20 0.38
▸ PABPC1 P11940 1/20 0.38
▸ RECQL P46063 1/20 0.38
▸ GALK1 P51570 1/20 0.38
▸ CASP7 P55210 1/20 0.38
▸ CASP6 P55212 1/20 0.38
▸ MCL1 Q07820 1/20 0.38

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
SCHEMBL16153930 0.88 MAG (0.52) SLC6A2HRASMAGPOLB
SCHEMBL6567769 0.82 L3MBTL1 (0.39) SLC6A2GJB2HRAS
SCHEMBL10831460 0.82 L3MBTL1 (0.39) SLC6A2GJB2HRAS
SCHEMBL15028536 0.82 GJB2 (0.46) GJB2GJA1SYNJ2
SCHEMBL15012689 0.81 SLC6A2 (0.58) SLC6A2GJB2HRASGJA1SYNJ2
SCHEMBL16153924 0.81 SLC6A2 (0.58) SLC6A2GJB2HRASGJA1SYNJ2
SCHEMBL16146188 0.81 SLC6A2 (0.58) SLC6A2GJB2HRASGJA1SYNJ2
SCHEMBL7154934 0.79 MEN1 (0.41) SLC6A2
SCHEMBL1647584 0.74 SSTR1 (0.45) SLC6A2GJB2GJA1
SCHEMBL12650358 0.74 MEN1 (0.40) SLC6A2HRASSYNJ2

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
US-20140303363-A1 Preparation and Use of Isolactosamine and Intermediates therefor GLYCOM A/S (DK) 2014-10-09 — — 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-20140303363-A1 Preparation and Use of Isolactosamine and Intermediates therefor GALE, B4GALT1, GNE SLC6A2 3154/4885GJB2 1285/4885HRAS 3623/4885

“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.

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