SCHEMBL2604977

SCHEMBL2604977

C#CCCCn1c(Cc2cc(OC)c(OC)c(OC)c2Cl)nc2c(N)nc(F)nc21

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HSP90AA1 P07900 18/20 1.00
HSP90AB1 P08238 18/20 1.00
ERBB2 P04626 7/20 0.79
HSP90B1 P14625 1/20 0.47

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
SCHEMBL10149974 0.93 HSP90AA1 (0.87) HSP90AA1HSP90AB1ERBB2HSP90B1
SCHEMBL23819778 0.90 HSP90AA1 (0.81) HSP90AA1HSP90AB1ERBB2HSP90B1
SCHEMBL1864541 0.88 HSP90AA1 (1.00) HSP90AA1HSP90AB1ERBB2HSP90B1
SCHEMBL23450478 0.88 HSP90AA1 (0.79) HSP90AA1HSP90AB1ERBB2
SCHEMBL27584530 0.87 HSP90AA1 (0.77) HSP90AA1HSP90AB1ERBB2HSP90B1
SCHEMBL4854328 0.87 HSP90AA1 (1.00) HSP90AA1HSP90AB1ERBB2
SCHEMBL4462613 0.86 HSP90AA1 (0.77) HSP90AA1HSP90AB1ERBB2HSP90B1
SCHEMBL30583139 0.86 HSP90AA1 (0.77) HSP90AA1HSP90AB1ERBB2HSP90B1
SCHEMBL1859519 0.84 HSP90AA1 (0.80) HSP90AA1HSP90AB1ERBB2HSP90B1
SCHEMBL1864700 0.84 HSP90AA1 (0.80) HSP90AA1HSP90AB1ERBB2HSP90B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4661876-A1 METABOLIC INHIBITORS AND METHODS OF MAKING AND USING THEREOF University of Miami (US) 2025-12-17 EP claimed
WO-2024168133-A1 METABOLIC INHIBITORS AND METHODS OF MAKING AND USING THEREOF UNIVERSITY OF MIAMI (US) 2024-08-15 WO claimed
US-12616759-B2 Uses of labeled HSP90 inhibitors SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) 2026-05-05 US disclosed
EP-4682148-A2 APOPTOSIS-INDUCING AGENTS FOR THE TREATMENT OF CANCER AND IMMUNE AND AUTOIMMUNE DISEASES AbbVie Ireland Unlimited Company (IE) 2026-01-21 EP disclosed
EP-4661876-A1 METABOLIC INHIBITORS AND METHODS OF MAKING AND USING THEREOF University of Miami (US) 2025-12-17 EP disclosed
US-12473288-B2 Treatment of neurodegenerative diseases through inhibiton of Hsp90 SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) 2025-11-18 US disclosed
US-20250340550-A1 SALTS AND CRYSTALLINE FORMS OF AN APOPTOSIS-INDUCING AGENT ABBVIE INC (US) 2025-11-06 US disclosed
US-20250161318-A1 SOLID DISPERSIONS CONTAINING AN APOPTOSIS-INDUCING AGENT ABBVIE INC (US) 2025-05-22 US disclosed
US-20250145587-A1 BROMODOMAIN INHIBITORS ABBVIE INC (US) 2025-05-08 US disclosed
US-20250090504-A1 SMALL MOLECULE PEPTIDOMIMETIC FOR THE TREATMENT OF TAUOPATHIES STEALTH BIOTHERAPEUTICS INC. (US) 2025-03-20 US disclosed
CN-112703004-B Methods and compositions for cancer treatment using recombinant dendritic cells 雷诺瓦罗生物制药公司 2025-02-14 CN disclosed
WO-2007143630-A2 TREATMENT OF NEUROFIBROMATOSIS WITH HSP90 INHIBITORS NEXGENIX PHARMACEUTICALS (US) 2007-12-13 WO disclosed
US-7241890-B2 Purine analogs having HSP90-inhibiting activity CONFORMA THERAPEUTICS CORPORATION (US) 2007-07-10 US disclosed
WO-2007075572-A2 ORALLY ACTIVE PURINE-BASED INHIBITORS OF HEAT SHOCK PROTEIN 90 CONFORMA THERAPEUTICS CORPORATION (US) 2007-07-05 WO disclosed
US-20070129334-A1 Orally Active Purine-Based Inhibitors of Heat Shock Protein 90 CONFORMA THERAPEUTICS CORPORATION (US) 2007-06-07 US disclosed
US-20070129334-A1 Orally Active Purine-Based Inhibitors of Heat Shock Protein 90 CONFORMA THERAPEUTICS CORPORATION (US) 2007-06-07 US disclosed
EP-1335920-A4 SMALL MOLECULE COMPOSITIONS FOR BINDING TO HSP90 SLOAN KETTERING INSTITUTEFOR C (US) 2005-08-17 EP disclosed
US-20040102458-A1 Small molecule compositions for binding to hsp90 SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH 2004-05-27 US disclosed
EP-1335920-A2 SMALL MOLECULE COMPOSITIONS FOR BINDING TO HSP90 Sloan-Kettering Institute For Cancer Research (US) 2003-08-20 EP disclosed
WO-2002036075-A2 SMALL MOLECULE COMPOSITIONS FOR BINDING TO HSP90 SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) 2002-05-10 WO 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 (8 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-20250340550-A1 SALTS AND CRYSTALLINE FORMS OF AN APOPTOSIS-INDUCING AGENT BCL2, BAD, BAX HSP90AA1 192/4885HSP90AB1 117/4885ERBB2 1234/4885
US-20250090504-A1 SMALL MOLECULE PEPTIDOMIMETIC FOR THE TREATMENT OF TAUOPATHIES MAPT, PSEN1, PSEN2 HSP90AA1 532/4885HSP90AB1 332/4885ERBB2 4309/4885
US-20070129334-A1 Orally Active Purine-Based Inhibitors of Heat Shock Protein 90 HSP90AB1, HSP90AA1, HSP90AB2P HSP90AA1 2/4885HSP90AB1 1/4885ERBB2 1609/4885
US-20250161318-A1 SOLID DISPERSIONS CONTAINING AN APOPTOSIS-INDUCING AGENT BCL2, BAX, BCL2L1 HSP90AA1 765/4885HSP90AB1 453/4885ERBB2 2872/4885
US-20040102458-A1 Small molecule compositions for binding to hsp90 HSP90AB1, ERBB2, HSP90AB2P HSP90AA1 5/4885HSP90AB1 1/4885ERBB2 2/4885
US-12616759-B2 Uses of labeled HSP90 inhibitors HSP90AB1, HSP90B1, HSP90AB2P HSP90AA1 4/4885HSP90AB1 1/4885ERBB2 756/4885
US-20250145587-A1 BROMODOMAIN INHIBITORS BRD4, BRD3, BRD1 HSP90AA1 3128/4885HSP90AB1 2807/4885ERBB2 2062/4885
US-12473288-B2 Treatment of neurodegenerative diseases through inhibiton of Hsp90 HSP90B1, HSP90AB1, HSP90AB2P HSP90AA1 4/4885HSP90AB1 2/4885ERBB2 3171/4885

“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.