SCHEMBL458800

SCHEMBL458800

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nearest known ligand 0.34

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
AKR1B1 P15121 1/20 0.34
MPI P34949 1/20 0.33
LMNA P02545 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
TDP1 Q9NUW8 1/20 0.32

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
SCHEMBL22692162 0.88 AKR1B1 (0.37) AKR1B1MPILMNAL3MBTL1
SCHEMBL309709 0.84 LMNA (0.39) AKR1B1MPILMNAL3MBTL1TDP1
SCHEMBL458623 0.84 LMNA (0.39) AKR1B1MPILMNAL3MBTL1TDP1
SCHEMBL8857020 0.84 LMNA (0.39) AKR1B1MPILMNAL3MBTL1TDP1
SCHEMBL14409028 0.80 AKR1B1 (0.34) AKR1B1MPILMNAL3MBTL1TDP1
SCHEMBL1367677 0.80 AKR1B1 (0.34) AKR1B1MPILMNAL3MBTL1TDP1
SCHEMBL2635114 0.80 AKR1B1 (0.34) AKR1B1MPILMNAL3MBTL1TDP1
SCHEMBL7151920 0.80 AKR1B1 (0.34) AKR1B1MPILMNAL3MBTL1TDP1
SCHEMBL3408591 0.80 AKR1B1 (0.34) AKR1B1MPILMNAL3MBTL1TDP1
SCHEMBL4288124 0.80 AKR1B1 (0.34) AKR1B1MPILMNAL3MBTL1TDP1

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 115 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090324682-A1 Medical stent provided with inhibitors of atp synthesis INTERSTITIAL THERAPEUTICS (CH) 2009-12-31 US claimed
EP-1789030-A2 MEDICAL IMPLANT PROVIDED WITH INHIBITORS OF ATP SYNTHESIS Interstitial Therapeutics (CH) 2007-05-30 EP claimed
EP-1789107-A2 MEDICAL STENT PROVIDED WITH INHIBITORS OF ATP SYNTHESIS Interstitial Therapeutics (CH) 2007-05-30 EP claimed
WO-2006024488-A2 MEDICAL STENT PROVIDED WITH INHIBITORS OF ATP SYNTHESIS INTERSTITIAL THERAPEUTICS (CH) 2006-03-09 WO claimed
WO-2006024490-A2 METHODS AND COMPOSITIONS FOR THE TREATMENT OF CELL PROLIFERATION INTERSTITIAL THERAPEUTICS (CH) 2006-03-09 WO claimed
WO-2006024491-A1 METHODS AND COMPOSITIONS FOR THE TREATMENT OF CELL PROLIFERATION INTERSTITIAL THERAPEUTICS (CH) 2006-03-09 WO claimed
WO-2006024492-A2 MEDICAL IMPLANT PROVIDED WITH INHIBITORS OF ATP SYNTHESIS INTERSTITIAL THERAPEUTICS (CH) 2006-03-09 WO claimed
US-20060025351-A1 Cancer treatment including glycolytic inhibitors LAMPIDIS THEODORE J 2006-02-02 US claimed
US-20050043250-A1 Cancer treatment including glycolytic inhibitors LAMPIDIS THEODORE J (US) 2005-02-24 US claimed
US-12414934-B2 Combination therapies Aardvark Therapeutics, Inc. (US) 2025-09-16 US disclosed
EP-4582080-A1 DISPENSER FOR MUCOSAL ADMINISTRATION COMPRISING 2-DEOXY-GLUCOSE OR ANALOGUES THEREOF G.ST Antivirals GmbH (AT) 2025-07-09 EP disclosed
WO-2024137472-A2 COMBINATION THERAPIES MEI PHARMA, INC. (US) 2024-06-27 WO disclosed
EP-3399026-B1 REPROGRAMMING OF CELLS TO A NEW FATE SCRIPPS RESEARCH INST (US) 2024-06-26 EP disclosed
CN-116139125-A Combination therapy 梅制药公司 2023-05-23 CN disclosed
US-20050020682-A1 Systems and methods for treating human inflammatory and proliferative diseases and wounds, with fatty acid metabolism inhibitors and/or glycolytic inhibitors REGENTS OF THE UNIVERSITY OF COLORADO, THE 2005-01-27 US disclosed
WO-2004111199-A2 SYSTEMS AND METHODS FOR TREATING HUMAN INFLAMMATORY AND PROLIFERATIVE DISEASES AND WOUNDS, WITH FATTY ACID METABOLISM INHIBITORS AND/OR GLYCOLYTIC INHIBITORS UNIVERSITY OF COLORADO SYSTEM TECHNOLOGY (US) 2004-12-23 WO disclosed
US-6670330-B1 Treating human breast cancer LAMPIDIS THEODORE J (US) 2003-12-30 US disclosed
US-20030181393-A1 Cancer treatment including glycolytic inhibitors LAMPIDIS THEODORE J (US) 2003-09-25 US disclosed
EP-1322304-A1 MANIPULATION OF OXIDATIVE PHOSPHORYLATION FOR HYPERSENSITIZING TUMOR CELLS TO GLYCOLYTIC INHIBITORS Lampidis, Theodore J. (US) 2003-07-02 EP disclosed
WO-2001082926-A1 MANIPULATION OF OXIDATIVE PHOSPHORYLATION FOR HYPERSENSITIZING TUMOR CELLS TO GLYCOLYTIC INHIBITORS LAMPIDIS THEODORE J (US) 2001-11-08 WO 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-12414934-B2 Combination therapies PCK2, PDK1, PCK1 AKR1B1 924/4885MPI 365/4885LMNA 3656/4885
US-20090324682-A1 Medical stent provided with inhibitors of atp synthesis ATP5ME, ATP5F1A, ATP5MG AKR1B1 2102/4885MPI 193/4885LMNA 4786/4885
US-20060025351-A1 Cancer treatment including glycolytic inhibitors HIF1AN, ALDOA, G6PD AKR1B1 128/4885MPI 225/4885LMNA 4687/4885
US-20050043250-A1 Cancer treatment including glycolytic inhibitors HIF1AN, ALDOA, G6PD AKR1B1 128/4885MPI 225/4885LMNA 4687/4885
US-20030181393-A1 Cancer treatment including glycolytic inhibitors HIF1AN, ALDOA, G6PD AKR1B1 128/4885MPI 225/4885LMNA 4687/4885
US-20050020682-A1 Systems and methods for treating human inflammatory and proliferative diseases and wounds, with fatty acid metabolism inhibitors and/or glycolytic inhibitors FASN, G6PD, HK2 AKR1B1 200/4885MPI 867/4885LMNA 4726/4885

“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.