SCHEMBL29405735

SCHEMBL29405735

NC[C@@H]1OC(C(=O)NCCCC[C@@H]2NC(=O)[C@@H](Cc3ccccc3)NC(=O)[C@@H](CC(=O)O)NC(=O)CNC(=O)[C@H](CCCN=C(N)N)NC2=O)[C@H](O)C(O)C1O

nearest known ligand 0.62

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ ITGB3 P05106 20/20 0.62
▸ ITGAV P06756 16/20 0.62
▸ ITGA5 P08648 3/20 0.62
▸ ITGB1 P05556 1/20 0.62
▸ ITGA2B P08514 4/20 0.59
▸ ITGB5 P18084 9/20 0.58

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
Trifluoroacetic Acid SCHEMBL30116037 0.96 ITGB3 (0.61) ITGB3ITGAVITGA5ITGB1ITGA2B
SCHEMBL13481946 0.90 ITGB3 (0.50) ITGB3ITGAVITGA5ITGB1ITGA2B
SCHEMBL13481608 0.90 ITGB3 (0.50) ITGB3ITGAVITGA5ITGB1ITGA2B
SCHEMBL31294830 0.83 ITGB3 (0.80) ITGB3ITGAVITGA5ITGB1ITGA2B
SCHEMBL29366713 0.82 ITGB3 (0.74) ITGB3ITGAVITGA5ITGB1ITGA2B
SCHEMBL17364341 0.82 ITGB3 (0.74) ITGB3ITGAVITGA5ITGB1ITGA2B
SCHEMBL14075702 0.81 MC4R (0.44) ITGB3ITGAVITGA5ITGB1ITGB5
SCHEMBL13465281 0.81 ITGB3 (0.49) ITGB3ITGAVITGA5ITGB1ITGA2B
SCHEMBL18080800 0.81 ITGB3 (0.49) ITGB3ITGAVITGA5ITGB1ITGA2B
SCHEMBL13481610 0.81 ITGB3 (0.49) ITGB3ITGAVITGA5ITGB1ITGA2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240254085-A1 CHELATORS FOR RADIOMETALS AND METHODS OF MAKING AND USING SAME THE UNIVERSITY OF BRITISH COLUMBIA (CA) 2024-08-01 — — US claimed
EP-4334290-A1 CHELATORS FOR RADIOMETALS AND METHODS OF MAKING AND USING SAME The University of British Columbia (CA) 2024-03-13 — — EP claimed
US-20230348378-A1 SMALL MOLECULE ALBUMIN BINDERS OREGON HEALTH & SCIENCE UNIVERSITY 2023-11-02 — — US claimed
EP-4110768-A1 CHELATOR COMPOSITIONS FOR RADIOMETALS AND METHODS OF USING SAME Triumf Inc. (CA) 2023-01-04 — — EP claimed
WO-2022232943-A1 CHELATORS FOR RADIOMETALS AND METHODS OF MAKING AND USING SAME THE UNIVERSITY OF BRITISH COLUMBIA (CA) 2022-11-10 — — WO claimed
WO-2022040607-A1 SMALL MOLECULE ALBUMIN BINDERS OREGON HEALTH & SCIENCE UNIVERSITY (US) 2022-02-24 — — WO claimed
EP-3634474-B1 TARGETING MODULES FOR UNIVERSAL CHIMERIC ANTIGEN RECEPTOR EXPRESSING IMMUNE CELLS AND USE IN THE TREATMENT OF CANCER INFECTIONS AND AUTOIMMUNE DISORDERS AVENCELL EUROPE GMBH (DE) 2026-05-06 — — EP disclosed
US-12605447-B2 Stable formulations for radionuclide complexes ITM SOLUCIN GMBH (DE) 2026-04-21 — — US disclosed
US-12562258-B2 Methods and systems for assessing treatment of a disease based on lesion features AIQ GLOBAL INC. (US) 2026-02-24 — — US disclosed
US-20260027239-A1 cRGD -CONJUGATED IMAGING AGENT CURADEL SURGICAL INNOVATIONS, INC. (US) 2026-01-29 — — US disclosed
US-12514939-B2 Stable radiopharmaceutical compositions and uses thereof ALPHA-9 ONCOLOGY, INC. (CA) 2026-01-06 — — US disclosed
US-20250255993-A1 STABLE RADIOPHARMACEUTICAL COMPOSITIONS AND USES THEREOF ALPHA-9 ONCOLOGY INC. (CA) 2025-08-14 — — US disclosed
EP-4585609-A1 RGD DIMER COMPOUND, AND PREPARATION METHOD THEREFOR AND USE THEREOF Yantai Lannacheng Biotechnology Co., Ltd. (CN) 2025-07-16 — — EP disclosed
US-20220133919-A1 ONE STEP 64Cu-BaBaSar-RGD2 PRODUCTION METHOD UNIV SOUTHERN CALIFORNIA (US) 2022-05-05 — — US disclosed
US-20220119488-A1 BICYCLIC PEPTIDE LIGANDS SPECIFIC FOR INTEGRIN ALPHA-V-BETA-3 Bicyclerd Limited (GB) 2022-04-21 — — US disclosed
EP-3965751-A1 PARA-AMINOHIPPURIC ACID (PAH) AS A RENAL PROTECTIVE SUBSTANCE ITM Isotope Technologies Munich SE (DE) 2022-03-16 — — EP disclosed
EP-3965892-A1 BICYCLIC PEPTIDE LIGANDS SPECIFIC FOR INTEGRIN ALPHA V BETA 3 Bicyclerd Limited (GB) 2022-03-16 — — EP disclosed
US-20220064221-A1 BICYCLIC PEPTIDE LIGANDS SPECIFIC FOR INTEGRIN ALPHA-V-BETA-3 BICYCLETX LIMITED (GB) 2022-03-03 — — US disclosed
CN-114126654-A Para-aminohippuric acid (PAH) as a kidney protective substance 同位素技术慕尼黑有限公司 2022-03-01 — — CN disclosed
WO-2022040607-A1 SMALL MOLECULE ALBUMIN BINDERS OREGON HEALTH & SCIENCE UNIVERSITY (US) 2022-02-24 — — 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-12605447-B2 Stable formulations for radionuclide complexes EPOR, CD47, PRCP ITGB3 1415/4885ITGAV 861/4885ITGA5 1268/4885
US-20220119488-A1 BICYCLIC PEPTIDE LIGANDS SPECIFIC FOR INTEGRIN ALPHA-V-BETA-3 ITGB3, ITGAV, ITGB2 ITGB3 1/4885ITGAV 2/4885ITGA5 15/4885
US-20220064221-A1 BICYCLIC PEPTIDE LIGANDS SPECIFIC FOR INTEGRIN ALPHA-V-BETA-3 ITGB3, ITGAV, ITGB1 ITGB3 1/4885ITGAV 2/4885ITGA5 11/4885
US-20250255993-A1 STABLE RADIOPHARMACEUTICAL COMPOSITIONS AND USES THEREOF RCN1, RABL6, QPCT ITGB3 2423/4885ITGAV 1694/4885ITGA5 2186/4885
US-12562258-B2 Methods and systems for assessing treatment of a disease based on lesion features VHL, HRAS, MKI67 ITGB3 2987/4885ITGAV 2071/4885ITGA5 4394/4885
US-20260027239-A1 cRGD -CONJUGATED IMAGING AGENT ADGRF1, FZD7, RXFP3 ITGB3 4/4885ITGAV 19/4885ITGA5 32/4885
US-20230348378-A1 SMALL MOLECULE ALBUMIN BINDERS ALB, FABP1, FABP3 ITGB3 1258/4885ITGAV 944/4885ITGA5 2649/4885
US-20240254085-A1 CHELATORS FOR RADIOMETALS AND METHODS OF MAKING AND USING SAME RXFP3, SLC39A3, NR4A3 ITGB3 582/4885ITGAV 2732/4885ITGA5 3199/4885

“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.

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