(S)-1',6,6',7,7'-Hexahydroxy-3,3'-Dimethyl-N5-((S)-2-Phenylpropyl)-N5'-((S)-2-Phenylpropyl)-2,2'-Binaphthyl-5,5'-Dicarboxamide (Atropisomeric Mix)

(S)-1',6,6',7,7'-Hexahydroxy-3,3'-Dimethyl-N5-((S)-2-Phenylpropyl)-N5'-((S)-2-Phenylpropyl)-2,2'-Binaphthyl-5,5'-Dicarboxamide (Atropisomeric Mix)

SCHEMBL3265587

Cc1cc2c(C(=O)NCC(C)c3ccccc3)c(O)c(O)cc2c(O)c1-c1c(C)cc2c(C(=O)NCC(C)c3ccccc3)c(O)c(O)cc2c1O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
BCL2L1 Q07817 18/20 1.00
BCL2 P10415 14/20 1.00
MCL1 Q07820 14/20 1.00
BCL2A1 Q16548 11/20 1.00
BAK1 Q16611 3/20 1.00
NPC1 O15118 1/20 0.48
RAB9A P51151 1/20 0.48
TP53 P04637 1/20 0.45
MAPT P10636 1/20 0.45

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
1,1',6,6',7,7'-Hexahydroxy-3,3'-Dimethyl-N5-((R)-2-Phenylpropyl)-N5'-((R)-2-Phenylpropyl)-2,2'-Binaphthyl-5,5'-Dicarboxamide (Atropisomeric Mix) SCHEMBL18213906 1.00 BCL2L1 (1.00) BCL2L1BCL2MCL1BCL2A1BAK1
(S)-1',6,6',7,7'-Hexahydroxy-3,3'-Dimethyl-N5-((S)-2-Phenylpropyl)-N5'-((S)-2-Phenylpropyl)-2,2'-Binaphthyl-5,5'-Dicarboxamide (Atropisomeric Mix) SCHEMBL2757199 1.00 BCL2L1 (1.00) BCL2L1BCL2MCL1BCL2A1BAK1
(S)-1',6,6',7,7'-Hexahydroxy-3,3'-Dimethyl-N5-((S)-2-Phenylpropyl)-N5'-((S)-2-Phenylpropyl)-2,2'-Binaphthyl-5,5'-Dicarboxamide (Atropisomeric Mix) SCHEMBL2757182 1.00 BCL2L1 (1.00) BCL2L1BCL2MCL1BCL2A1BAK1
1,1',6,6',7,7'-Hexahydroxy-3,3'-Dimethyl-N5-((R)-2-Phenylpropyl)-N5'-((R)-2-Phenylpropyl)-2,2'-Binaphthyl-5,5'-Dicarboxamide (Atropisomeric Mix) SCHEMBL29637073 1.00 BCL2L1 (1.00) BCL2L1BCL2MCL1BCL2A1BAK1
1,1',6,6',7,7'-Hexahydroxy-3,3'-Dimethyl-N5-((R)-2-Phenylpropyl)-N5'-((R)-2-Phenylpropyl)-2,2'-Binaphthyl-5,5'-Dicarboxamide (Atropisomeric Mix) SCHEMBL29378446 1.00 BCL2L1 (1.00) BCL2L1BCL2MCL1BCL2A1BAK1
(S)-1',6,6',7,7'-Hexahydroxy-3,3'-Dimethyl-N5-((S)-2-Phenylpropyl)-N5'-((S)-2-Phenylpropyl)-2,2'-Binaphthyl-5,5'-Dicarboxamide (Atropisomeric Mix) SCHEMBL2757198 1.00 BCL2L1 (1.00) BCL2L1BCL2MCL1BCL2A1BAK1
SCHEMBL19419614 0.98 BCL2L1 (0.96) BCL2L1BCL2MCL1BCL2A1BAK1
SCHEMBL14922147 0.98 BCL2L1 (0.96) BCL2L1BCL2MCL1BCL2A1BAK1
SCHEMBL10112880 0.96 BCL2L1 (0.92) BCL2L1BCL2MCL1BCL2A1BAK1
SCHEMBL25100354 0.95 BCL2L1 (0.90) BCL2L1BCL2MCL1BCL2A1BAK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023147011-A1 COMPOSITIONS AND METHODS FOR INHIBITING SEVERE ACUTE RESPIRATORY SYNDROME (SARS) CORONAVIRUS-2 (SARS-COV-2) VIMU THERAPEUTICS (US) 2023-08-03 WO disclosed
US-20220162561-A1 COMPOSITION FOR PROMOTING SECRETION OF EXTRACELLULAR VESICLES NISSAN CHEMICAL CORPORATION (JP) 2022-05-26 US disclosed
EP-3950060-A1 COMPOSITION FOR PROMOTING SECRETION OF EXTRACELLULAR VESICLES Nissan Chemical Corporation (JP) 2022-02-09 EP disclosed
US-10981927-B2 Bioactive compounds THE CAWTHRON INSTITUTE TRUST BOARD (NZ) 2021-04-20 US disclosed
US-20200368248-A1 MECHANISM OF RESISTANCE TO BET BROMODOMAIN INHIBITORS DANA-FARBER CANCER INSTITUTE, INC. (US) 2020-11-26 US disclosed
WO-2020204161-A1 COMPOSITION FOR PROMOTING SECRETION OF EXTRACELLULAR VESICLES 日産化学株式会社 2020-10-08 WO disclosed
US-20190352309-A1 BIOACTIVE COMPOUNDS THE CAWTHRON INSTITUTE TRUST BOARD (NZ) 2019-11-21 US disclosed
US-10364250-B2 Bioactive compounds THE CAWTHRON INSTITUTE TRUST BOARD (NZ) 2019-07-30 US disclosed
US-10195213-B2 Chemical entities that kill senescent cells for use in treating age-related disease UNITY BIOTECHNOLOGY, INC. (US) 2019-02-05 US disclosed
US-10040780-B2 Mcl-1 antagonists THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2018-08-07 US disclosed
US-20170066747-A1 MCL-1 ANTAGONISTS THE ROYAL INSTITUTION FOR THE ADVANCEMENT OF LEARNING/MCGILL UNIVERSITY (CA) 2017-03-09 US disclosed
US-8487131-B2 Optically pure apogossypol derivative as pan-active inhibitor of anti-apoptotic B-cell lymphoma/leukemia-2 (BCL-2) SANFORD-BURNHAM MEDICAL RESEARCH INSTITUTE (US) 2013-07-16 US disclosed
US-8487131-B2 Optically pure apogossypol derivative as pan-active inhibitor of anti-apoptotic B-cell lymphoma/leukemia-2 (BCL-2) SANFORD-BURNHAM MEDICAL RESEARCH INSTITUTE (US) 2013-07-16 US disclosed
US-8436207-B2 Naphthalene-based inhibitors of anti-apoptotic proteins BURNHAM INSTITUTE FOR MEDICAL RESEARCH (US) 2013-05-07 US disclosed
US-20120004311-A1 OPTICALLY PURE APOGOSSYPOL DERIVATIVE AS PAN-ACTIVE INHIBITOR OF ANTI-APOPTOTIC B-CELL LYMPHOMA/LEUKEMIA-2 (BCL-2) SANFORD-BURNHAM MEDICAL RESEARCH INSTITUTE (US) 2012-01-05 US disclosed
US-8039668-B2 Naphthalene-based inhibitors of anti-apoptotic proteins BURNHAM INSTITUTE FOR MEDICAL RESEARCH (US) 2011-10-18 US disclosed
US-8039668-B2 Naphthalene-based inhibitors of anti-apoptotic proteins BURNHAM INSTITUTE FOR MEDICAL RESEARCH (US) 2011-10-18 US disclosed
US-20100267781-A1 NAPHTHALENE-BASED INHIBITORS OF ANTI-APOPTOTIC PROTEINS BURNHAM INSTITUTE FOR MEDICAL RESEARCH (US) 2010-10-21 US disclosed
US-20100267781-A1 NAPHTHALENE-BASED INHIBITORS OF ANTI-APOPTOTIC PROTEINS BURNHAM INSTITUTE FOR MEDICAL RESEARCH (US) 2010-10-21 US disclosed
US-20100267781-A1 NAPHTHALENE-BASED INHIBITORS OF ANTI-APOPTOTIC PROTEINS BURNHAM INSTITUTE FOR MEDICAL RESEARCH (US) 2010-10-21 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 (9 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-10040780-B2 Mcl-1 antagonists MCL1, BAK1, BCL3 BCL2L1 4/4885BCL2 9/4885MCL1 1/4885
US-10981927-B2 Bioactive compounds BCL9, BCL9L, MALT1 BCL2L1 47/4885BCL2 49/4885MCL1 10/4885
US-10364250-B2 Bioactive compounds CYP8B1, AHR, ALOX12 BCL2L1 115/4885BCL2 396/4885MCL1 3689/4885
US-20170066747-A1 MCL-1 ANTAGONISTS MCL1, BAK1, BCL3 BCL2L1 4/4885BCL2 9/4885MCL1 1/4885
US-20190352309-A1 BIOACTIVE COMPOUNDS BCL9, BCL9L, MALT1 BCL2L1 47/4885BCL2 49/4885MCL1 10/4885
US-20100267781-A1 NAPHTHALENE-BASED INHIBITORS OF ANTI-APOPTOTIC PROTEINS HAX1, BAX, APOL1 BCL2L1 20/4885BCL2 11/4885MCL1 233/4885
US-20200368248-A1 MECHANISM OF RESISTANCE TO BET BROMODOMAIN INHIBITORS BET1, BRD2, BRD4 BCL2L1 83/4885BCL2 121/4885MCL1 93/4885
US-10195213-B2 Chemical entities that kill senescent cells for use in treating age-related disease TP53, CDKN1A, GLA BCL2L1 464/4885BCL2 132/4885MCL1 8/4885
US-20120004311-A1 OPTICALLY PURE APOGOSSYPOL DERIVATIVE AS PAN-ACTIVE INHIBITOR OF ANTI-APOPTOTIC B-CELL LYMPHOMA/LEUKEMIA-2 (BCL-2) BCL3, BCL9, BCL2 BCL2L1 6/4885BCL2 3/4885MCL1 5/4885

“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.