Erastin

Erastin

SCHEMBL4457820

CCOc1ccccc1-n1c(C(C)N2CCN(C(=O)COc3ccc(Cl)cc3)CC2)nc2ccccc2c1=O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SLC7A11 Q9UPY5 15/20 1.00
VDAC2 P45880 1/20 1.00
HIF1A Q16665 3/20 0.51
LMNA P02545 1/20 0.49
MAPK1 P28482 1/20 0.49

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
Erastin SCHEMBL31385520 1.00 SLC7A11 (1.00) SLC7A11VDAC2HIF1ALMNAMAPK1
Erastin SCHEMBL22213543 1.00 SLC7A11 (1.00) SLC7A11VDAC2HIF1ALMNAMAPK1
Erastin SCHEMBL29370998 1.00 SLC7A11 (1.00) SLC7A11VDAC2HIF1ALMNAMAPK1
SCHEMBL13633718 0.94 SLC7A11 (0.89) SLC7A11VDAC2HIF1ALMNA
SCHEMBL1593568 0.94 SLC7A11 (0.88) SLC7A11VDAC2HIF1ALMNAMAPK1
SCHEMBL25793246 0.93 SLC7A11 (0.87) SLC7A11VDAC2HIF1ALMNA
SCHEMBL5440840 0.92 SLC7A11 (0.85) SLC7A11VDAC2HIF1ALMNA
SCHEMBL14222558 0.92 SLC7A11 (0.85) SLC7A11VDAC2HIF1ALMNA
SCHEMBL4519119 0.92 SLC7A11 (0.85) SLC7A11VDAC2HIF1ALMNAMAPK1
SCHEMBL4463410 0.91 SLC7A11 (0.84) SLC7A11VDAC2HIF1ALMNAMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260034094-A1 COMPOSITIONS AND METHODS FOR INDUCING FERROPTOSIS KOJIN THERAPEUTICS INC (US) 2026-02-05 US disclosed
US-20250108036-A1 COMPOSITIONS FOR REMOVING SENESCENT CELLS AND USES THEREOF LIFECEUTIX CO., LTD. (KR) 2025-04-03 US disclosed
CN-119548483-A Application of aloe-emodin in preparing medicine for treating cisplatin-induced acute kidney injury 延安大学 2025-03-04 CN disclosed
CN-118987230-A Application of I-type collagen/Slc 7a11 regulation shaft in vascular remodeling 蔡菁菁 2024-11-22 CN disclosed
EP-4431102-A1 COMPOSITIONS FOR REMOVING SENESCENT CELLS AND USES THEREOF Lifeceutix Co., Ltd. (KR) 2024-09-18 EP disclosed
US-20240207270-A1 COMPOUNDS AND COMPOSITIONS FOR MODULATING LIPID METABOLISM WAVEBREAK INC (US) 2024-06-27 US disclosed
US-20240207270-A1 COMPOUNDS AND COMPOSITIONS FOR MODULATING LIPID METABOLISM WAVEBREAK INC (US) 2024-06-27 US disclosed
CN-117695393-A Application of GPX4 inhibitor in preparation of medicament for treating scleroderma skin fibrosis 复旦大学附属华山医院 2024-03-15 CN disclosed
CN-117582418-A Co-delivery system of chemical drug and nucleic acid drug, and preparation method and application thereof 天津医科大学 2024-02-23 CN disclosed
US-20230226185-A1 METHODS AND COMPOSITIONS FOR INDUCING FERROPTOSIS IN VIVO Kojin Therapeutics, Inc. 2023-07-20 US disclosed
WO-2009108384-A2 COMPOUNDS AND COMPOSITIONS THAT CAUSE NON-APOPTOTIC CELL DEATH AND USES THEREOF TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2009-09-03 WO disclosed
US-20090214465-A1 Quinoxaline Derivatives as Antitumor Agents PROLEXYS PHARMACEUTICALS, INC. (US) 2009-08-27 US disclosed
US-20090214465-A1 Quinoxaline Derivatives as Antitumor Agents PROLEXYS PHARMACEUTICALS, INC. (US) 2009-08-27 US disclosed
US-20080299076-A1 Compunds and compositions that cause non-apoptotic cell death and uses thereof NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2008-12-04 US disclosed
US-20080220454-A1 Identification of genotype- selective anti-tumor agents WHITEHEAD INSTITUTE FOR BIOMEDICAL RESEARCH (US) 2008-09-11 US disclosed
US-7358262-B2 Identification of genotype-selective anti-tumor agents WHITEHEAD INSTITUTE FOR BIOMEDICAL RESEARCH (US) 2008-04-15 US disclosed
US-7358262-B2 Identification of genotype-selective anti-tumor agents WHITEHEAD INSTITUTE FOR BIOMEDICAL RESEARCH (US) 2008-04-15 US disclosed
WO-2008013840-A2 ERASTIN ANALOGS AND USES THEREOF TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2008-01-31 WO disclosed
US-20070161644-A1 Erastin analogs and uses thereof STOCKWELL BRENT R 2007-07-12 US disclosed
US-20070161644-A1 Erastin analogs and uses thereof STOCKWELL BRENT R 2007-07-12 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-20080299076-A1 Compunds and compositions that cause non-apoptotic cell death and uses thereof BAD, CASP3, BAX SLC7A11 2266/4885VDAC2 801/4885HIF1A 910/4885
US-20070161644-A1 Erastin analogs and uses thereof ERAP2, ERAP1, ERAL1 SLC7A11 1250/4885VDAC2 3980/4885HIF1A 928/4885
US-20230226185-A1 METHODS AND COMPOSITIONS FOR INDUCING FERROPTOSIS IN VIVO AIFM2, GPX4, SLC40A1 SLC7A11 44/4885VDAC2 2370/4885HIF1A 168/4885
US-20260034094-A1 COMPOSITIONS AND METHODS FOR INDUCING FERROPTOSIS AIFM2, GPX4, HMOX1 SLC7A11 30/4885VDAC2 610/4885HIF1A 326/4885
US-20240207270-A1 COMPOUNDS AND COMPOSITIONS FOR MODULATING LIPID METABOLISM CPT2, PC, SREBF2 SLC7A11 906/4885VDAC2 553/4885HIF1A 726/4885
US-20250108036-A1 COMPOSITIONS FOR REMOVING SENESCENT CELLS AND USES THEREOF GLA, LIMS1, TP53 SLC7A11 4786/4885VDAC2 517/4885HIF1A 1737/4885
US-20090214465-A1 Quinoxaline Derivatives as Antitumor Agents VDAC3, VDAC2, VDAC1 SLC7A11 565/4885VDAC2 2/4885HIF1A 2396/4885

“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.