SCHEMBL727062

SCHEMBL727062

CCC(CN1CC(=O)NC(=O)C1)N1CC(=O)NC(=O)C1

nearest known ligand 0.62

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TOP2A P11388 3/20 0.62
TOP2B Q02880 3/20 0.62
PTGS1 P23219 2/20 0.62
LMNA P02545 2/20 0.62
ALDH1A1 P00352 1/20 0.48
MAPT P10636 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
CRBN Q96SW2 1/20 0.33
KDM4E B2RXH2 1/20 0.31
CYP2C19 P33261 1/20 0.31

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
SCHEMBL9752758 1.00 TOP2A (0.62) TOP2ATOP2BPTGS1LMNAALDH1A1
SCHEMBL9752445 0.88 TOP2A (0.50) TOP2ATOP2BPTGS1LMNAALDH1A1
Dexrazoxane SCHEMBL1586271 0.77 TOP2A (1.00) TOP2ATOP2BPTGS1LMNAALDH1A1
Dexrazoxane SCHEMBL18400 0.77 TOP2A (1.00) TOP2ATOP2BPTGS1LMNAALDH1A1
Razoxane SCHEMBL9089 0.77 TOP2A (1.00) TOP2ATOP2BPTGS1LMNAALDH1A1
Razoxane SCHEMBL3339694 0.77 TOP2A (1.00) TOP2ATOP2BPTGS1LMNAALDH1A1
Razoxane SCHEMBL27748349 0.76 TOP2A (0.96) TOP2ATOP2BPTGS1LMNAALDH1A1
Dexrazoxane SCHEMBL18188 0.76 TOP2A (0.96) TOP2ATOP2BPTGS1LMNAALDH1A1
Razoxane SCHEMBL27174203 0.76 TOP2A (0.96) TOP2ATOP2BPTGS1LMNAALDH1A1
Dexrazoxane SCHEMBL18189 0.74 TOP2A (0.93) TOP2ATOP2BPTGS1LMNAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2575810-A1 CANCER THERAPY USING A COMBINATION OF A HSP90 INHIBITORY COMPOUND AND A TOPOISOMERASE II INHIBITOR Synta Pharmaceuticals Corp. (US) 2013-04-10 EP claimed
WO-2011149824-A1 CANCER THERAPY USING A COMBINATION OF A HSP90 INHIBITORY COMPOUND AND A TOPOISOMERASE II INHIBITOR SYNTA PHARMACEUTICALS CORP. (US) 2011-12-01 WO claimed
JP-2011524851-A 2011-09-08 JP claimed
EP-2242360-A2 DOXORUBICIN ADJUVANTS TO REDUCE TOXICITY AND METHODS FOR USING THE SAME Tosk, Inc. (US) 2010-10-27 EP claimed
WO-2009102808-A2 DOXORUBICIN ADJUVANTS TO REDUCE TOXICITY AND METHODS FOR USING THE SAME TOSK, INCORPORATED (US) 2009-08-20 WO claimed
WO-1991000729-A2 BIS-DIOXOPIPERAZINES, AND THEIR USE AS PROTECTING AGENTS NATIONAL RESEARCH DEVELOPMENT CORPORATION (GB) 1991-01-24 WO claimed
EP-0409499-A2 Pharmaceutical compositions BTG INTERNATIONAL LIMITED (GB) 1991-01-23 EP claimed
WO-2021144746-A1 USE OF ICRF-193 DERIVATIVES AND PHARMACEUTICAL PREPARATIONS CONTAINING THEREOF FOR THE PREVENTION OF CHRONIC CUMULATIVE CARDIOTOXICITY CAUSED BY THERAPY WITH ANTHRACYCLINE ANTICANCER DRUGS UNIVERZITA KARLOVA V PRAZE (CZ) 2021-07-22 WO disclosed
WO-2018160758-A1 USE OF DIANHYDROGALACTITOL OR ANALOGS AND DERIVATIVES IN COMBINATION WITH A P53 MODULATOR OR A PARP INHIBITOR BACHA JEFFREY A (CA) 2018-09-07 WO disclosed
US-9468613-B2 Doxorubicin adjuvants to reduce toxicity and methods for using the same TOSK, INC. (US) 2016-10-18 US disclosed
US-20150258046-A1 Doxorubicin Adjuvants to Reduce Toxicity and Methods for Using the Same TOSK, INC. 2015-09-17 US disclosed
US-9061038-B2 Doxorubicin adjuvants to reduce toxicity and methods for using the same TOSK, INCORPORATED (US) 2015-06-23 US disclosed
EP-2242360-B1 DOXORUBICIN ADJUVANTS TO REDUCE TOXICITY AND METHODS FOR USING THE SAME TOSK INC (US) 2015-04-08 EP disclosed
US-20100144704-A1 Method of reducing amyloid-beta peptide levels using a bisdioxopiperazine THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES 2010-06-10 US disclosed
US-20090325893-A1 DOXORUBICIN ADJUVANTS TO REDUCE TOXICITY AND METHODS FOR USING THE SAME TOSK, INCORPORATED 2009-12-31 US disclosed
WO-2009102808-A2 DOXORUBICIN ADJUVANTS TO REDUCE TOXICITY AND METHODS FOR USING THE SAME TOSK, INCORPORATED (US) 2009-08-20 WO disclosed
EP-2035003-A1 A METHOD OF REDUCING AMYLOID-BETA PEPTIDE LEVELS USING A BISDIOXOPIPERAZINE The Govt Of The USA, As Represented By The Secretary, Department Of Health And Human Services (US) 2009-03-18 EP disclosed
WO-2007146178-A1 A METHOD OF REDUCING AMYLOID-BETA PEPTIDE LEVELS USING A BISDIOXOPIPERAZINE THE GOVT OF THE USA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES, (US) 2007-12-21 WO disclosed
WO-1991000729-A2 BIS-DIOXOPIPERAZINES, AND THEIR USE AS PROTECTING AGENTS NATIONAL RESEARCH DEVELOPMENT CORPORATION (GB) 1991-01-24 WO disclosed
EP-0409499-A2 Pharmaceutical compositions BTG INTERNATIONAL LIMITED (GB) 1991-01-23 EP 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 (3 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-20100144704-A1 Method of reducing amyloid-beta peptide levels using a bisdioxopiperazine IAPP, APP, BACE1 TOP2A 2986/4885TOP2B 2227/4885PTGS1 3563/4885
US-20150258046-A1 Doxorubicin Adjuvants to Reduce Toxicity and Methods for Using the Same TOP2A, TLR5, MYD88 TOP2A 1/4885TOP2B 5/4885PTGS1 384/4885
US-20090325893-A1 DOXORUBICIN ADJUVANTS TO REDUCE TOXICITY AND METHODS FOR USING THE SAME TOP2A, TLR5, MYD88 TOP2A 1/4885TOP2B 5/4885PTGS1 384/4885

“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.