SCHEMBL12947359

SCHEMBL12947359

CCCCOC1C(O)C(O)OC(CO)C1O

nearest known ligand 0.61

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ SLC2A1 P11166 1/20 0.61
▸ GBA1 P04062 4/20 0.46
▸ MAPK1 P28482 2/20 0.44
▸ GJB2 P29033 1/20 0.38
▸ TNF P01375 1/20 0.37
▸ ADORA2A P29274 1/20 0.37
▸ ADORA2B P29275 1/20 0.37
▸ LGALS8 O00214 1/20 0.37
▸ LGALS3 P17931 1/20 0.37
▸ LGALS4 P56470 1/20 0.37

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
SCHEMBL6277000 0.93 SLC2A1 (0.67) SLC2A1GBA1MAPK1GJB2TNF
SCHEMBL11222662 0.93 SLC2A1 (0.54) SLC2A1GBA1MAPK1GJB2TNF
SCHEMBL10388278 0.93 SLC2A1 (0.54) SLC2A1GBA1MAPK1GJB2TNF
SCHEMBL16678877 0.93 SLC2A1 (0.54) SLC2A1GBA1MAPK1GJB2TNF
SCHEMBL14500937 0.92 SLC2A1 (0.52) SLC2A1GBA1MAPK1GJB2TNF
SCHEMBL16377619 0.92 SLC2A1 (0.52) SLC2A1GBA1MAPK1GJB2TNF
SCHEMBL16330459 0.92 SLC2A1 (0.52) SLC2A1GBA1MAPK1GJB2TNF
SCHEMBL6950601 0.88 SLC2A1 (0.49) SLC2A1GBA1MAPK1GJB2ADORA2A
SCHEMBL8435866 0.88 SLC2A1 (0.49) SLC2A1GBA1MAPK1GJB2ADORA2A
SCHEMBL16678933 0.88 SLC2A1 (0.56) SLC2A1GBA1MAPK1GJB2TNF

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-9149489-B2 Inhibitors of glycolysis useful in the treatment of brain tumors BOARD OF REGENTS, UNIVERSITY OF TEXAS SYSTEM (US) 2015-10-06 — — US disclosed
US-20110003758-A1 Inhibitors of Glycolysis Useful In the Treatment of Brain Tumors NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2011-01-06 — — 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-20110003758-A1 Inhibitors of Glycolysis Useful In the Treatment of Brain Tumors PDK2, G6PD, PCK2 SLC2A1 45/4885GBA1 380/4885MAPK1 1111/4885

“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.

Send feedback