SCHEMBL1303375

SCHEMBL1303375

CC(N)NC(=O)OC(C)(C)C

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.53
CA2 P00918 2/20 0.53
CA7 P43166 2/20 0.53
CYP2D6 P10635 1/20 0.47
CTSK P43235 10/20 0.45
CTSS P25774 5/20 0.45
CTSL P07711 1/20 0.42
CTSB P07858 1/20 0.42
KMT2A Q03164 2/20 0.41
CA12 O43570 1/20 0.41
CA14 Q9ULX7 1/20 0.41
TSHR P16473 1/20 0.41
HSD17B10 Q99714 1/20 0.41
CA4 P22748 1/20 0.39
CA9 Q16790 1/20 0.39
MEN1 O00255 1/20 0.39
GAA P10253 1/20 0.39

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
Hydrochloric Acid SCHEMBL16632537 0.98 CA1 (0.52) CA1CA2CA7CYP2D6CTSK
SCHEMBL23875083 0.84 CA1 (0.50) CA1CA2CA7CYP2D6CTSK
SCHEMBL14923484 0.83 CA1 (0.50) CA1CA2CA7CYP2D6CTSK
SCHEMBL17564382 0.83 CA1 (0.50) CA1CA2CA7CYP2D6CTSK
SCHEMBL14923699 0.83 CA1 (0.50) CA1CA2CA7CYP2D6CTSK
SCHEMBL14923728 0.83 CA1 (0.50) CA1CA2CA7CYP2D6CTSK
SCHEMBL14923533 0.83 CA1 (0.50) CA1CA2CA7CYP2D6CTSK
SCHEMBL13617298 0.83 CA1 (0.50) CA1CA2CA7CYP2D6CTSK
SCHEMBL22383165 0.83 CA1 (0.50) CA1CA2CA7CYP2D6CTSK
SCHEMBL25534687 0.82 CA1 (0.48) CA1CA2CA7CYP2D6CTSK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100145070-A1 ANTI-CANCER COMPOUND AND MANUFACTURING METHOD THEREOF NATIONAL DEFENSE MEDICAL CENTER (TW) 2010-06-10 US claimed
US-20080138817-A1 Novel Functional Peptide Nucleic Acid Monomer and Process for Producing the Same CREDIA JAPAN CO., LTD. (JP) 2008-06-12 US claimed
EP-1318142-B1 T-BUTOXYCARBONYLAMINOETHYLAMINE FOR THE SYNTHESIS OF PNA MONOMER UNITS, AMINO ACID DERIVATIVES, INTERMEDIATES THEREOF, AND PROCESSES FOR PRODUCTIONS OF THEM CREDIA JAPAN CO LTD (JP) 2007-04-11 EP claimed
US-20050187402-A1 T-butoxycarbonylaminoethylamine for the synthesis of PNA monomer units, amino acid derivatives, intermediates thereof, and processes for productions of them CREDIA JAPAN CO., LTD. (JP) 2005-08-25 US claimed
US-20040101839-A1 Novel functional peptide nucleic acid monomer and process for producing the same CREDIA JAPAN CO., LTD. (JP) 2004-05-27 US claimed
US-20040039224-A1 T-butoxycarbonylaminoethylamine for the synthesis of pna monomer units, amino acid derivatives, intermediates thereof, and processes for productions of them CREDIA JAPAN CO., LTD. (JP) 2004-02-26 US claimed
EP-1357112-A1 NOVEL FUNCTIONAL PEPTIDE NUCLEIC ACID MONOMER AND PROCESS FOR PRODUCING THE SAME Applied Biosystems Japan Ltd. (JP) 2003-10-29 EP claimed
EP-1318142-A1 T-BUTOXYCARBONYLAMINOETHYLAMINE FOR THE SYNTHESIS OF PNA MONOMER UNITS, AMINO ACID DERIVATIVES, INTERMEDIATES THEREOF, AND PROCESSES FOR PRODUCTIONS OF THEM Applied Biosystems Japan Ltd. (JP) 2003-06-11 EP claimed
US-20240082417-A1 PROTEIN-POLYMER DRUG CONJUGATES ASANA BIOSCIENCES, LLC 2024-03-14 US disclosed
US-20240058371-A1 MOLECULE FOR INDUCING SPONTANEOUS CALCIFICATION OF TUMOR CELLS AND USE THEREOF ZHEJIANG UNIVERSITY (CN) 2024-02-22 US disclosed
WO-2023144723-A1 IMMUNOCONJUGATES COMPRISING KALLIKREIN RELATED PEPTIDASE 2 ANTIGEN BINDING DOMAINS AND THEIR USES JANSSEN BIOTECH, INC. (US) 2023-08-03 WO disclosed
US-20230183326-A1 PROTEIN-POLYMER-DRUG CONJUGATES ASANA BIOSCIENCES, LLC 2023-06-15 US disclosed
WO-2023084396-A1 MACROCYCLIC COMPOUNDS AND METHODS OF MAKING THE SAME JANSSEN BIOTECH, INC. (US) 2023-05-19 WO disclosed
US-20230057350-A1 A CONJUGATE OF AN AMANITA TOXIN WITH BRANCHED LINKERS HANGZHOU DAC BIOTECH CO., LTD. (CN) 2023-02-23 US disclosed
WO-1997001579-A2 SOMATOSTATIN PEPTIDES NOVARTIS AG (CH) 1997-01-16 WO disclosed
US-5587478-A BONDING TO OLIGONUCLEOTIDES, DRUG DELIVERY, THERAPHY BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 1996-12-24 US disclosed
WO-1996030377-A1 NITROGENOUS MACROCYCLIC COMPOUNDS ISIS PHARMACEUTICALS, INC. (US) 1996-10-03 WO disclosed
US-5470855-A Anticoagulants SANOFI (FR) 1995-11-28 US disclosed
US-5204482-A Ethylenediamine monoamide heteroaryl derivatives HOFFMAN-LAROCHE INC. (US) 1993-04-20 US disclosed
US-5011849-A Monoamine oxidase inhibitors HOFFMANN-LA ROCHE INC. (US) 1991-04-30 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 (9 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-20230057350-A1 A CONJUGATE OF AN AMANITA TOXIN WITH BRANCHED LINKERS BTN3A1, ANTXR2, CLTA CA1 670/4885CA2 1750/4885CA7 1193/4885
US-20100145070-A1 ANTI-CANCER COMPOUND AND MANUFACTURING METHOD THEREOF DCK, DHPS, DHX15 CA1 2711/4885CA2 3718/4885CA7 2220/4885
US-20240058371-A1 MOLECULE FOR INDUCING SPONTANEOUS CALCIFICATION OF TUMOR CELLS AND USE THEREOF CASR, CALCOCO2, CACYBP CA1 25/4885CA2 6/4885CA7 202/4885
US-20040101839-A1 Novel functional peptide nucleic acid monomer and process for producing the same NSUN3, NSUN2, RNGTT CA1 2420/4885CA2 1902/4885CA7 2214/4885
US-20230183326-A1 PROTEIN-POLYMER-DRUG CONJUGATES PBRM1, STAMBP, TSPO CA1 3384/4885CA2 3833/4885CA7 3439/4885
US-20050187402-A1 T-butoxycarbonylaminoethylamine for the synthesis of PNA monomer units, amino acid derivatives, intermediates thereof, and processes for productions of them BCAT1, BCAT2, RNGTT CA1 1059/4885CA2 3002/4885CA7 2159/4885
US-20040039224-A1 T-butoxycarbonylaminoethylamine for the synthesis of pna monomer units, amino acid derivatives, intermediates thereof, and processes for productions of them BCAT1, BCAT2, RNGTT CA1 648/4885CA2 1906/4885CA7 1254/4885
US-20080138817-A1 Novel Functional Peptide Nucleic Acid Monomer and Process for Producing the Same NSUN3, RNGTT, NSUN2 CA1 3208/4885CA2 2398/4885CA7 3271/4885
US-20240082417-A1 PROTEIN-POLYMER DRUG CONJUGATES PBRM1, STAMBP, TSPO CA1 3216/4885CA2 3677/4885CA7 3317/4885

“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.