SCHEMBL516041

SCHEMBL516041

O=C(O)CN(CCN(CC(=O)O)C(O)c1ccccc1)C(O)c1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.42
MAPK1 P28482 1/20 0.42
GABBR2 O75899 1/20 0.39
GABBR1 Q9UBS5 1/20 0.39
CYP2C19 P33261 1/20 0.39
SLC6A9 P48067 1/20 0.39
CYP2D6 P10635 1/20 0.39
SRC P12931 1/20 0.39
CES2 O00748 2/20 0.38
CES1 P23141 2/20 0.38
KDM4E B2RXH2 1/20 0.38
ATM Q13315 1/20 0.38
OPRD1 P41143 1/20 0.37
BCAT2 O15382 1/20 0.37

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
SCHEMBL11218815 0.92 LMNA (0.45) LMNAMAPK1GABBR2GABBR1CYP2C19
SCHEMBL24177002 0.92 OPRD1 (0.45) LMNASLC6A9CYP2D6KDM4EATM
SCHEMBL644556 0.78 CYP2D6 (0.43) LMNAMAPK1GABBR2GABBR1CYP2C19
SCHEMBL11077681 0.78 CYP2D6 (0.43) LMNAMAPK1GABBR2GABBR1CYP2C19
SCHEMBL11671946 0.78 SRC (0.43) LMNAMAPK1GABBR2GABBR1CYP2C19
SCHEMBL11588776 0.77 GAA (0.50) LMNAGABBR2GABBR1KDM4E
SCHEMBL6727027 0.77 TDP1 (0.48) LMNAMAPK1GABBR2GABBR1CYP2C19
SCHEMBL10820763 0.76 CYP2D6 (0.41) LMNAMAPK1GABBR2GABBR1CYP2C19
SCHEMBL16153014 0.74 OPRD1 (0.41) LMNAMAPK1GABBR2GABBR1CYP2C19
SCHEMBL16656809 0.74 ALOX5 (0.52) CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240165281-A1 DUAL MODE RADIOTRACER AND THERAPEUTICS UNIV MUENCHEN TECH (DE) 2024-05-23 US claimed
EP-4337270-A1 RADIOPHARMACEUTICAL SOMATOSTATIN RECEPTOR LIGANDS AND PRECURSORS THEREOF Technische Universität München (DE) 2024-03-20 EP claimed
EP-4291250-A1 DUAL MODE RADIOTRACER AND THERAPEUTICS Technische Universität München (DE) 2023-12-20 EP claimed
EP-4291252-A1 CXCR4-LIGANDS FOR DIAGNOSTIC AND THERAPEUTIC USE AND PRECURSORS THEREOF Technische Universität München (DE) 2023-12-20 EP claimed
US-20230390394-A1 Bismuth-Gadolinium Nanoparticles NH THERAGUIX (FR) 2023-12-07 US claimed
US-20230277698-A1 SILICON-CONTAINING LIGAND COMPOUNDS Technische Universität München (DE) 2023-09-07 US claimed
US-11559590-B2 Granzyme B directed imaging and therapy THE GENERAL HOSPITAL CORPORATION (US) 2023-01-24 US claimed
US-20220175975-A1 HER3 Peptides for Imaging and Radiotherapy THE GENERAL HOSPITAL CORPORATION 2022-06-09 US claimed
US-20220118120-A1 CANCER DIAGNOSTIC IMAGING AGENTS Technische Universität München (DE) 2022-04-21 US claimed
US-11241511-B2 HER3 peptides for imaging and radiotherapy THE GENERAL HOSPITAL CORPORATION (US) 2022-02-08 US claimed
EP-0752873-A1 LABELLED PEPTIDE COMPOUNDS MALLINCKRODT MEDICAL, INC. (US) 1997-01-15 EP claimed
WO-1995022341-A1 LABELLED PEPTIDE COMPOUNDS MALLINCKRODT MEDICAL, INC. (US) 1995-08-24 WO claimed
EP-0436005-B1 LABELED POLYPEPTIDE DERIVATIVES SANDOZ LTD (CH) 1995-03-29 EP claimed
EP-0478631-B1 TARGETTING AGENTS CANCER RES CAMPAIGN TECH (GB) 1994-08-24 EP claimed
EP-0584256-A1 METHOD FOR DETECTING AN LOCALIZING TISSUES HAVING NEUROKININE 1 RECEPTORS MALLINCKRODT MEDICAL, INC. (US) 1994-03-02 EP claimed
WO-1992018536-A2 METHOD FOR DETECTING AN LOCALIZING TISSUES HAVING NEUROKININE 1 RECEPTORS MALLINCKRODT MEDICAL, INC. (US) 1992-10-29 WO claimed
EP-0498771-A2 MSH peptide derivatives SANDOZ LTD. (CH) 1992-08-12 EP claimed
EP-0436005-A1 LABELED POLYPEPTIDE DERIVATIVES. SANDOZ LTD (CH) 1991-07-10 EP claimed
WO-1991001144-A1 LABELED POLYPEPTIDE DERIVATIVES SANDOZ LTD (CH) 1991-02-07 WO claimed
WO-1990006949-A2 PEPTIDE DERIVATIVES SANDOZ AG (CH) 1990-06-28 WO claimed

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-11559590-B2 Granzyme B directed imaging and therapy GZMB, CTSB, PRF1 LMNA 1420/4885MAPK1 3920/4885GABBR2 1340/4885
US-20220175975-A1 HER3 Peptides for Imaging and Radiotherapy ERBB3, EGFR, NGLY1 LMNA 4456/4885MAPK1 3082/4885GABBR2 4220/4885
US-20230277698-A1 SILICON-CONTAINING LIGAND COMPOUNDS KLK3, SHBG, SELPLG LMNA 4022/4885MAPK1 2661/4885GABBR2 4017/4885
US-20240165281-A1 DUAL MODE RADIOTRACER AND THERAPEUTICS FOLH1, KLK3, PAICS LMNA 3949/4885MAPK1 1540/4885GABBR2 2853/4885
US-11241511-B2 HER3 peptides for imaging and radiotherapy ERBB3, EGFR, NGLY1 LMNA 4456/4885MAPK1 3082/4885GABBR2 4220/4885
US-20230390394-A1 Bismuth-Gadolinium Nanoparticles BRCA1, GMNN, GNG2 LMNA 1858/4885MAPK1 3255/4885GABBR2 1156/4885
US-20220118120-A1 CANCER DIAGNOSTIC IMAGING AGENTS FOLH1, FOLR1, KLK3 LMNA 3587/4885MAPK1 3975/4885GABBR2 2568/4885

“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.