Macbecin

Macbecin

SCHEMBL443301

COC1C[C@H](C)[C@@H](OC)C2=CC(=O)C=C(NC(=O)/C(C)=C/C=C\[C@H](C)C(OC(N)=O)/C(C)=C/[C@@H](C)[C@@H]1OC)C2=O

nearest known ligand 0.90

Full drug profile on Sugi Atlas →

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HSP90AA1 P07900 17/20 0.77
ALDH1A1 P00352 1/20 0.51
ERBB2 P04626 1/20 0.48
HSP90AB1 P08238 4/20 0.46
PDGFRA P16234 1/20 0.38

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
Macbecin SCHEMBL2682391 1.00 HSP90AA1 (0.77) HSP90AA1ALDH1A1ERBB2HSP90AB1PDGFRA
Macbecin SCHEMBL2682389 1.00 HSP90AA1 (0.77) HSP90AA1ALDH1A1ERBB2HSP90AB1PDGFRA
Macbecin SCHEMBL12800037 1.00 HSP90AA1 (0.77) HSP90AA1ALDH1A1ERBB2HSP90AB1PDGFRA
Macbecin SCHEMBL2682385 1.00 HSP90AA1 (0.77) HSP90AA1ALDH1A1ERBB2HSP90AB1PDGFRA
Macbecin SCHEMBL2682394 1.00 HSP90AA1 (0.77) HSP90AA1ALDH1A1ERBB2HSP90AB1PDGFRA
Macbecin SCHEMBL13040915 1.00 HSP90AA1 (0.77) HSP90AA1ALDH1A1ERBB2HSP90AB1PDGFRA
Macbecin SCHEMBL13040899 1.00 HSP90AA1 (0.77) HSP90AA1ALDH1A1ERBB2HSP90AB1PDGFRA
Herbimycin SCHEMBL25344099 0.95 HSP90AA1 (0.86) HSP90AA1ALDH1A1ERBB2HSP90AB1PDGFRA
Herbimycin SCHEMBL29420374 0.95 HSP90AA1 (0.86) HSP90AA1ALDH1A1ERBB2HSP90AB1PDGFRA
Herbimycin SCHEMBL21578242 0.95 HSP90AA1 (0.86) HSP90AA1ALDH1A1ERBB2HSP90AB1PDGFRA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10758526-B2 Combination therapies using agents that target tumor-associated stroma or tumor cells and other pathways THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES NATIONAL INSTITUTES OF HEALTH (US) 2020-09-01 US disclosed
US-20170095575-A1 COMBINATION THERAPIES USING AGENTS THAT TARGET TUMOR-ASSOCIATED STROMA OR TUMOR CELLS AND OTHER PATHWAYS BIOMED VALLEY DISCOVERIES, INC. (US) 2017-04-06 US disclosed
US-20150283147-A1 TREATING POLYCYSTIC KIDNEY DISEASE WITH HSP90 INHIBITORY COMPOUNDS THE INSTITUTE FOR CANCER RESEARCH D/B/A THE RESEARCH INSTITUTE OF FOX CHASE CANCER CENTER 2015-10-08 US disclosed
EP-2914259-A1 TREATING POLYCYSTIC KIDNEY DISEASE WITH HSP90 INHIBITORY COMPOUNDS Synta Pharmaceuticals Corp. (US) 2015-09-09 EP disclosed
US-20150150850-A1 TREATING CANCER WITH HSP90 INHIBITORY COMPOUNDS SYNTA PHARMACEUTICALS CORP (US) 2015-06-04 US disclosed
US-20150099721-A1 TREATING CANCER WITH HSP90 INHIBITORY COMPOUNDS SYNTA PHARMACEUTICALS CORP. (US) 2015-04-09 US disclosed
EP-2849751-A1 TREATING CANCER WITH HSP90 INHIBITORY COMPOUNDS Synta Pharmaceuticals Corp. (US) 2015-03-25 EP disclosed
US-8906885-B2 Treating cancer with HSP90 inhibitory compounds SYNTA PHARMACEUTICALS CORP. (US) 2014-12-09 US disclosed
US-20140294808-A1 TREATING CANCER WITH HSP90 INHIBITORY COMPOUNDS SYNTA PHARMACEUTICALS CORP. (US) 2014-10-02 US disclosed
EP-2729144-A2 TREATING CANCER WITH HSP90 INHIBITORY COMPOUNDS Synta Pharmaceuticals Corp. (US) 2014-05-14 EP disclosed
US-20140127740-A1 METHODS OF IDENTIFYING HSP90 INHIBITORS WITH LESS OCULAR TOXICITY SYNTA PHARMACEUTICALS CORP. (US) 2014-05-08 US disclosed
WO-2014063080-A1 TREATING POLYCYSTIC KIDNEY DISEASE WITH HSP90 INHIBITORY COMPOUNDS SYNTA PHARMACEUTICALS CORP. (US) 2014-04-24 WO disclosed
US-8628752-B2 Methods of identifying HSP90 inhibitors with less ocular toxicity LSI FINANCING LLC, AS ADMINISTRATIVE AGENT 2014-01-14 US disclosed
WO-2013170159-A1 TREATING CANCER WITH HSP90 INHIBITORY COMPOUNDS SYNTA PHARMACEUTICALS CORP. (US) 2013-11-14 WO disclosed
EP-2616063-A1 HSP90 INHIBITORS FOR TREATING NON-SMALL CELL LUNG CANCERS IN WILD-TYPE EGFR AND/OR KRAS PATIENTS Synta Pharmaceuticals Corp. (US) 2013-07-24 EP disclosed
US-20130109045-A1 METHODS OF IDENTIFYING HSP90 INHIBITORS WITH LESS OCULAR TOXICITY SYNTA PHARMACEUTICALS CORP. (US) 2013-05-02 US disclosed
WO-2013006864-A2 TREATING CANCER WITH HSP90 INHIBITORY COMPOUNDS SYNTA PHARMACEUTICALS CORP. (US) 2013-01-10 WO disclosed
WO-2012037072-A1 HSP90 INHIBITORS FOR TREATING NON-SMALL CELL LUNG CANCERS IN WILD-TYPE EGFR AND/OR KRAS PATIENTS SYNTA PHARMACEUTICALS CORPORATION (US) 2012-03-22 WO disclosed
US-20120064175-A1 HSP90 Inhibitors for Treating Non-Small Cell Lung Cancer in Wild-Type EGFR and/or KRAS Patients SYNTA PHARMACEUTICALS CORP. 2012-03-15 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 (7 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-20150283147-A1 TREATING POLYCYSTIC KIDNEY DISEASE WITH HSP90 INHIBITORY COMPOUNDS HSP90B1, HSP90AB1, HSP90AA1 HSP90AA1 3/4885ALDH1A1 2361/4885ERBB2 933/4885
US-20150099721-A1 TREATING CANCER WITH HSP90 INHIBITORY COMPOUNDS ROS1, RET, HSP90AB1 HSP90AA1 4/4885ALDH1A1 733/4885ERBB2 64/4885
US-10758526-B2 Combination therapies using agents that target tumor-associated stroma or tumor cells and other pathways IGLV6-57, IGSF11, TNFRSF9 HSP90AA1 1604/4885ALDH1A1 2310/4885ERBB2 545/4885
US-20170095575-A1 COMBINATION THERAPIES USING AGENTS THAT TARGET TUMOR-ASSOCIATED STROMA OR TUMOR CELLS AND OTHER PATHWAYS IGLV6-57, IGSF11, TNFRSF9 HSP90AA1 1604/4885ALDH1A1 2310/4885ERBB2 545/4885
US-20150150850-A1 TREATING CANCER WITH HSP90 INHIBITORY COMPOUNDS HSP90AB1, MET, HSP90AA1 HSP90AA1 3/4885ALDH1A1 289/4885ERBB2 32/4885
US-20120064175-A1 HSP90 Inhibitors for Treating Non-Small Cell Lung Cancer in Wild-Type EGFR and/or KRAS Patients HSP90AB1, HSP90AA1, HSP90B1 HSP90AA1 2/4885ALDH1A1 2934/4885ERBB2 20/4885
US-20140294808-A1 TREATING CANCER WITH HSP90 INHIBITORY COMPOUNDS HSP90AB1, MET, HSP90AA1 HSP90AA1 3/4885ALDH1A1 285/4885ERBB2 33/4885

“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.