SCHEMBL17867773

SCHEMBL17867773

CCCCCOC[C@H]1OC(OCCCCC)C[C@@H](O)[C@@H]1O

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ GJB2 P29033 4/20 0.42
▸ ALDH1A1 P00352 1/20 0.41
▸ TDP1 Q9NUW8 1/20 0.41
▸ GBA1 P04062 3/20 0.39
▸ LGALS8 O00214 1/20 0.39
▸ LGALS3 P17931 1/20 0.39
▸ LGALS4 P56470 1/20 0.39
▸ SPHK2 Q9NRA0 1/20 0.38
▸ SPHK1 Q9NYA1 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ TNF P01375 1/20 0.36
▸ GBA2 Q9HCG7 6/20 0.35

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
SCHEMBL17867772 1.00 GJB2 (0.42) GJB2ALDH1A1TDP1GBA1LGALS8
SCHEMBL16148734 0.85 LGALS8 (0.51) GJB2GBA1LGALS8LGALS3LGALS4
SCHEMBL16148735 0.85 LGALS8 (0.51) GJB2GBA1LGALS8LGALS3LGALS4
SCHEMBL17117018 0.85 LGALS8 (0.38) GJB2GBA1LGALS8LGALS3LGALS4
SCHEMBL24155775 0.84 LGALS8 (0.53) GJB2GBA1LGALS8LGALS3LGALS4
SCHEMBL469613 0.84 LGALS8 (0.53) GJB2GBA1LGALS8LGALS3LGALS4
SCHEMBL19772749 0.84 LGALS8 (0.53) GJB2GBA1LGALS8LGALS3LGALS4
SCHEMBL17867743 0.84 ALDH1A1 (0.44) GJB2ALDH1A1TDP1GBA1SPHK2
SCHEMBL17867742 0.84 ALDH1A1 (0.44) GJB2ALDH1A1TDP1GBA1SPHK2
SCHEMBL7794269 0.81 ALDH1A1 (0.44) GJB2ALDH1A1TDP1GBA1SPHK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11925654-B2 Esters of 2-deoxy-monosaccharides with anti proliferative activity BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2024-03-12 — — US disclosed
US-20220023326-A1 ESTERS OF 2-DEOXY-MONOSACCHARIDES WITH ANTI PROLIFERATIVE ACTIVITY UNIV TEXAS (US) 2022-01-27 — — US disclosed
EP-3939595-A1 ESTERS OF 2-DEOXY-MONOSACCHARIDES WITH ANTI PROLIFERATIVE ACTIVITY Board of Regents, The University of Texas System (US) 2022-01-19 — — EP disclosed
US-11026960-B2 Esters of 2-deoxy-monosaccharides with anti proliferative activity BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2021-06-08 — — US disclosed
US-20190224225-A1 ESTERS OF 2-DEOXY-MONOSACCHARIDES WITH ANTI PROLIFERATIVE ACTIVITY BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM 2019-07-25 — — US disclosed
US-10201554-B2 Esters of 2-deoxy-monosacharides with anti proliferative activity BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2019-02-12 — — US disclosed
US-20160184336-A1 ESTERS OF 2-DEOXY-MONOSACHARIDES WITH ANTI PROLIFERATIVE ACTIVITY BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2016-06-30 — — 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 (6 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-10201554-B2 Esters of 2-deoxy-monosacharides with anti proliferative activity DERA, G6PD, HK2 GJB2 4484/4885ALDH1A1 484/4885TDP1 1580/4885
US-11925654-B2 Esters of 2-deoxy-monosaccharides with anti proliferative activity SLC2A2, SLC2A1, SLC2A4 GJB2 4808/4885ALDH1A1 375/4885TDP1 2098/4885
US-20190224225-A1 ESTERS OF 2-DEOXY-MONOSACCHARIDES WITH ANTI PROLIFERATIVE ACTIVITY SLC2A2, SLC2A1, SLC2A4 GJB2 4808/4885ALDH1A1 375/4885TDP1 2098/4885
US-11026960-B2 Esters of 2-deoxy-monosaccharides with anti proliferative activity SLC2A2, SLC2A1, SLC2A4 GJB2 4808/4885ALDH1A1 375/4885TDP1 2098/4885
US-20160184336-A1 ESTERS OF 2-DEOXY-MONOSACHARIDES WITH ANTI PROLIFERATIVE ACTIVITY DERA, G6PD, HK2 GJB2 4484/4885ALDH1A1 484/4885TDP1 1580/4885
US-20220023326-A1 ESTERS OF 2-DEOXY-MONOSACCHARIDES WITH ANTI PROLIFERATIVE ACTIVITY SLC2A2, SLC2A1, SLC2A4 GJB2 4808/4885ALDH1A1 375/4885TDP1 2098/4885

“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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