SCHEMBL681276

SCHEMBL681276

CN(C)CCC(CSc1ccccc1)Nc1ccc(S(=O)(=O)NC(=O)c2ccc(N3CCC(C)(C)CC3)cc2)cc1[N+](=O)[O-]

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
BCL2L1 Q07817 20/20 1.00
BCL2 P10415 16/20 1.00
ALB P02768 1/20 1.00
BCL2L2 Q92843 1/20 1.00

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
SCHEMBL681275 1.00 BCL2L1 (1.00) BCL2L1BCL2ALBBCL2L2
SCHEMBL31384063 1.00 BCL2L1 (1.00) BCL2L1BCL2ALBBCL2L2
SCHEMBL2946904 0.97 BCL2L1 (0.95) BCL2L1BCL2ALBBCL2L2
SCHEMBL2949972 0.95 BCL2L1 (1.00) BCL2L1BCL2ALBBCL2L2
SCHEMBL2950813 0.94 BCL2L1 (0.89) BCL2L1BCL2ALBBCL2L2
SCHEMBL376333 0.93 BCL2L1 (0.86) BCL2L1BCL2ALBBCL2L2
SCHEMBL2945317 0.91 BCL2L1 (0.83) BCL2L1BCL2ALBBCL2L2
SCHEMBL2951513 0.90 BCL2L1 (1.00) BCL2L1BCL2ALBBCL2L2
SCHEMBL4465505 0.90 BCL2L1 (0.88) BCL2L1BCL2ALBBCL2L2
SCHEMBL3953783 0.89 BCL2L1 (0.82) BCL2L1BCL2ALBBCL2L2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3331546-B1 CXCR4 INHIBITOR FOR THE TREATMENT OF CANCER BIOKINE THERAPEUTICS LTD (IL) 2023-10-04 EP disclosed
US-20210251944-A1 METHODS FOR TREATING A CANCER RESISTANT TO AT LEAST ONE TYROSINE KINASE INHIBITOR DEL MAR PHARMACEUTICALS (BC) LTD. (CA) 2021-08-19 US disclosed
US-11092602-B2 Methods and compositions relating to proteasome inhibitor resistance WHITEHEAD INSTITUTE FOR BIOMEDICAL RESEARCH (US) 2021-08-17 US disclosed
EP-2872161-B1 DIANHYDROGALACTITOL FOR USE IN TREATING TYROSINE-KINASE-INHIBITOR-RESISTANT MALIGNANCIES IN PATIENTS WITH GENETIC POLYMORPHISMS OR AHI1 DYSREGULATIONS OR MUTATIONS DEL MAR PHARMACEUTICALS (CA) 2020-12-16 EP disclosed
US-20180306796-A1 METHODS AND COMPOSITIONS RELATING TO PROTEASOME INHIBITOR RESISTANCE HOWARD HUGHES MEDICAL INSTITUTE 2018-10-25 US disclosed
US-20180221393-A1 CXCR4 BINDING AGENTS FOR TREATMENT OF DISEASES KREOS CAPITAL V (EXPERT FUND) L.P. (JE) 2018-08-09 US disclosed
EP-3331546-A1 CXCR4 BINDING AGENTS FOR TREATMENT OF DISEASES Biokine Therapeutics Ltd. (IL) 2018-06-13 EP disclosed
WO-2017021963-A1 CXCR4 BINDING AGENTS FOR TREATMENT OF DISEASES BIOKINE THERAPEUTICS LTD. (IL) 2017-02-09 WO disclosed
WO-2017007858-A1 METHODS AND COMPOSITIONS RELATING TO PROTEASOME INHIBITOR RESISTANCE WHITEHEAD INSTITUTE FOR BIOMEDICAL RESEARCH (US) 2017-01-12 WO disclosed
US-20150182490-A1 METHODS FOR TREATING TYROSINE-KINASE-INHIBITOR-RESISTANT MALIGNANCIES IN PATIENTS WITH GENETIC POLYMORPHISMS OR AHI1 DYSREGULATIONS OR MUTATIONS EMPLOYING DIANHYDROGALACTITOL, DIACETYLDIANHYDROGALACTITOL, DIBROMODULCITOL, OR ANALOGS OR DERIVATIVES THEREOF DEL MAR PHARMACEUTICALS (BC) LTD. (CA) 2015-07-02 US disclosed
EP-2872161-A2 METHODS FOR TREATING TYROSINE-KINASE-INHIBITOR-RESISTANT MALIGNANCIES IN PATIENTS WITH GENETIC POLYMORPHISMS OR AHI1 DYSREGULATIONS OR MUTATIONS EMPLOYING DIANHYDROGALACTITOL, DIACETYLDIANHYDROGALACTITOL, DIBROMODULCITOL, OR ANALOGS OR DERIVATIVES THEREOF Del Mar Pharmaceuticals (CA) 2015-05-20 EP disclosed
US-20150056186-A1 COMBINATION THERAPY OF A TYPE II ANTI-CD20 ANTIBODY WITH AN ANTI-BCL-2 ACTIVE AGENT HOFFMANN-LA ROCHE INC. (US) 2015-02-26 US disclosed
WO-2014004376-A2 METHODS FOR TREATING TYROSINE-KINASE-INHIBITOR-RESISTANT MALIGNANCIES IN PATIENTS WITH GENETIC POLYMORPHISMS OR AHI1 DYSREGULATIONS OR MUTATIONS EMPLOYING DIANHYDROGALACTITOL, DIACETYLDIANHYDROGALACTITOL, DIBROMODULCITOL, OR ANALOGS OR DERIVATIVES THEREOF DEL MAR PHARMACEUTICALS (CA) 2014-01-03 WO disclosed
US-20140004104-A1 COMBINATION THERAPY OF A TYPE II ANTI-CD20 ANTIBODY WITH AN ANTI-BCL-2 ACTIVE AGENT HOFFMANN-LA ROCHE INC. (US) 2014-01-02 US disclosed
EP-2604277-A1 Combination therapy of a type II anti-CD20 antibody with an anti-Bcl-2 active agent Roche Glycart AG (CH) 2013-06-19 EP disclosed
US-20120276085-A1 COMBINATION THERAPY OF A TYPE II ANTI-CD20 ANTIBODY WITH AN ANTI-BCL-2 ACTIVE AGENT Hoffman-La Roche. Inc. (US) 2012-11-01 US disclosed
US-20110287006-A1 COMBINATION THERAPY OF A TYPE II ANTI-CD20 ANTIBODY WITH AN ANTI-BCL-2 ACTIVE AGENT Hoffman-La Roche. Inc. (US) 2011-11-24 US disclosed
US-20110086025-A1 Combination Therapy of a Type II Anti-CD20 Antibody with an Anti-BCL-2 Active Agent Hoffman-La Roche. Inc. (US) 2011-04-14 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 (10 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-20150056186-A1 COMBINATION THERAPY OF A TYPE II ANTI-CD20 ANTIBODY WITH AN ANTI-BCL-2 ACTIVE AGENT BAK1, BCL2, BCL3 BCL2L1 7/4885BCL2 2/4885ALB 4760/4885
US-20150182490-A1 METHODS FOR TREATING TYROSINE-KINASE-INHIBITOR-RESISTANT MALIGNANCIES IN PATIENTS WITH GENETIC POLYMORPHISMS OR AHI1 DYSREGULATIONS OR MUTATIONS EMPLOYING DIANHYDROGALACTITOL, DIACETYLDIANHYDROGALACTITOL, DIBROMODULCITOL, OR ANALOGS OR DERIVATIVES THEREOF WHR1, AIPL1, TDP1 BCL2L1 40/4885BCL2 300/4885ALB 4845/4885
US-20210251944-A1 METHODS FOR TREATING A CANCER RESISTANT TO AT LEAST ONE TYROSINE KINASE INHIBITOR DCLRE1B, AIPL1, WHR1 BCL2L1 43/4885BCL2 341/4885ALB 4848/4885
US-11092602-B2 Methods and compositions relating to proteasome inhibitor resistance PSMG3, PSMB1, PSMB11 BCL2L1 922/4885BCL2 553/4885ALB 3944/4885
US-20110287006-A1 COMBINATION THERAPY OF A TYPE II ANTI-CD20 ANTIBODY WITH AN ANTI-BCL-2 ACTIVE AGENT BAK1, BCL2, BCL3 BCL2L1 7/4885BCL2 2/4885ALB 4760/4885
US-20120276085-A1 COMBINATION THERAPY OF A TYPE II ANTI-CD20 ANTIBODY WITH AN ANTI-BCL-2 ACTIVE AGENT BAK1, BCL2, BCL3 BCL2L1 7/4885BCL2 2/4885ALB 4760/4885
US-20110086025-A1 Combination Therapy of a Type II Anti-CD20 Antibody with an Anti-BCL-2 Active Agent BAK1, BCL2, BCL3 BCL2L1 7/4885BCL2 2/4885ALB 4760/4885
US-20180221393-A1 CXCR4 BINDING AGENTS FOR TREATMENT OF DISEASES CXCL12, CXCR4, CXCR1 BCL2L1 21/4885BCL2 14/4885ALB 4694/4885
US-20140004104-A1 COMBINATION THERAPY OF A TYPE II ANTI-CD20 ANTIBODY WITH AN ANTI-BCL-2 ACTIVE AGENT BAK1, BCL2, BCL3 BCL2L1 7/4885BCL2 2/4885ALB 4760/4885
US-20180306796-A1 METHODS AND COMPOSITIONS RELATING TO PROTEASOME INHIBITOR RESISTANCE PSMG3, PSMB1, PSMB11 BCL2L1 922/4885BCL2 553/4885ALB 3944/4885

“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.