SCHEMBL17867764

SCHEMBL17867764

CCCC(CCC)C(=O)O[C@H]1[C@H](OCc2ccccc2)CC(O)O[C@@H]1COCc1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ TACR2 P21452 3/20 0.43
▸ PDE4D Q08499 1/20 0.41
▸ NT5E P21589 1/20 0.40
▸ PTPN1 P18031 8/20 0.38
▸ CDC25B P30305 5/20 0.38
▸ GJB2 P29033 2/20 0.38
▸ PTPN2 P17706 4/20 0.37
▸ PTPN11 Q06124 3/20 0.37
▸ PTPN6 P29350 2/20 0.37
▸ BCHE P06276 1/20 0.36
▸ ACHE P22303 1/20 0.36
▸ KLK7 P49862 1/20 0.36
▸ KLK5 Q9Y337 1/20 0.36
▸ AGTR2 P50052 1/20 0.36

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
SCHEMBL17867758 1.00 TACR2 (0.43) TACR2PDE4DNT5EPTPN1CDC25B
SCHEMBL17867726 0.87 TACR2 (0.39) TACR2PDE4DNT5EPTPN1CDC25B
SCHEMBL17867761 0.86 TACR2 (0.44) TACR2PDE4DNT5EPTPN1CDC25B
SCHEMBL17867754 0.85 TACR2 (0.38) TACR2PDE4DNT5EPTPN1CDC25B
SCHEMBL21176708 0.83 TACR2 (0.44) TACR2PDE4DNT5EPTPN1CDC25B
SCHEMBL17867747 0.83 TACR2 (0.44) TACR2PDE4DNT5EPTPN1CDC25B
SCHEMBL16149014 0.82 TACR2 (0.48) TACR2NT5EPTPN1CDC25BGJB2
SCHEMBL24725536 0.81 PDE4D (0.52) TACR2PDE4DNT5EPTPN1GJB2
SCHEMBL18639181 0.81 PDE4D (0.52) TACR2PDE4DNT5EPTPN1GJB2
SCHEMBL22754536 0.81 PDE4D (0.52) TACR2PDE4DNT5EPTPN1GJB2

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 TACR2 4691/4885PDE4D 2119/4885NT5E 1799/4885
US-11925654-B2 Esters of 2-deoxy-monosaccharides with anti proliferative activity SLC2A2, SLC2A1, SLC2A4 TACR2 4635/4885PDE4D 2417/4885NT5E 2121/4885
US-20190224225-A1 ESTERS OF 2-DEOXY-MONOSACCHARIDES WITH ANTI PROLIFERATIVE ACTIVITY SLC2A2, SLC2A1, SLC2A4 TACR2 4635/4885PDE4D 2417/4885NT5E 2121/4885
US-11026960-B2 Esters of 2-deoxy-monosaccharides with anti proliferative activity SLC2A2, SLC2A1, SLC2A4 TACR2 4635/4885PDE4D 2417/4885NT5E 2121/4885
US-20160184336-A1 ESTERS OF 2-DEOXY-MONOSACHARIDES WITH ANTI PROLIFERATIVE ACTIVITY DERA, G6PD, HK2 TACR2 4691/4885PDE4D 2119/4885NT5E 1799/4885
US-20220023326-A1 ESTERS OF 2-DEOXY-MONOSACCHARIDES WITH ANTI PROLIFERATIVE ACTIVITY SLC2A2, SLC2A1, SLC2A4 TACR2 4635/4885PDE4D 2417/4885NT5E 2121/4885

“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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