SCHEMBL3745036

SCHEMBL3745036

CC(C)(C)OC(=O)N[C@@H](Cc1cn(C(=O)OC(C)(C)C)cn1)C(=O)ON1C(=O)CCC1=O

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ KLK7 P49862 2/20 0.35
▸ SCN9A Q15858 2/20 0.33
▸ CYP3A4 P08684 1/20 0.33
▸ TLR2 O60603 1/20 0.33
▸ TLR1 Q15399 1/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ MAPK1 P28482 1/20 0.33
▸ AKT1 P31749 1/20 0.32
▸ CPB2 Q96IY4 1/20 0.32
▸ TACR1 P25103 1/20 0.32
▸ CTSS P25774 2/20 0.32
▸ CTSL P07711 1/20 0.32
▸ CTSB P07858 1/20 0.32
▸ CTSK P43235 1/20 0.32

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
SCHEMBL3745041 1.00 KLK7 (0.35) KLK7SCN9ACYP3A4TLR2TLR1
SCHEMBL31482347 1.00 KLK7 (0.35) KLK7SCN9ACYP3A4TLR2TLR1
SCHEMBL25717615 0.94 KLK7 (0.35) KLK7SCN9ACYP3A4TLR2TLR1
SCHEMBL18207164 0.89 KDM4E (0.35) MEN1ALDH1A1KMT2AMAPK1
SCHEMBL18207163 0.89 KDM4E (0.35) MEN1ALDH1A1KMT2AMAPK1
SCHEMBL18218809 0.89 CPB2 (0.33) CPB2
SCHEMBL3439706 0.85 KLK5 (0.41) CPB2TACR1CTSSCTSLCTSB
SCHEMBL9838791 0.85 KLK5 (0.41) CPB2TACR1CTSSCTSLCTSB
SCHEMBL31001585 0.85 CPB2 (0.31) CPB2
SCHEMBL13650201 0.82 ITGB3 (0.45) MAPK1CPB2

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 16 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4408471-A2 BORYLATED DI-PEPTIDE AMINO ACID COMPOSITIONS FOR USE IN BORON NEUTRON CAPTURE THERAPY AND METHODS THEREOF Tae Life Sciences (US) 2024-08-07 — — EP disclosed
US-20240026051-A1 CATIONIC CYCLIC AMINE AND AMPHIPATHIC TRANSFECTION REAGENTS MIRUS BIO LLC 2024-01-25 — — US disclosed
US-20230357312-A1 Borylated Di-Peptide Amino Acid compositions for use in Boron Neutron Capture Therapy and methods thereof TAE LIFE SCIENCES LLC 2023-11-09 — — US disclosed
US-20230357312-A1 Borylated Di-Peptide Amino Acid compositions for use in Boron Neutron Capture Therapy and methods thereof TAE LIFE SCIENCES LLC 2023-11-09 — — US disclosed
US-11739174-B2 Cationic cyclic amine and amphipathic transfection reagents MIRUS BIO LLC (US) 2023-08-29 — — US disclosed
WO-2023113843-A2 BORYLATED DI-PEPTIDE AMINO ACID COMPOSITIONS FOR USE IN BORON NEUTRON CAPTURE THERAPY AND METHODS THEREOF TAE Life Sciences (US) 2023-06-22 — — WO disclosed
EP-4127026-A1 LINEAR COPOLYMER FOR GENE TRANSFECTION Polytheragene (FR) 2023-02-08 — — EP disclosed
US-9974862-B2 Lipid particles and nucleic acid delivery carrier FUJIFILM CORPORATION (JP) 2018-05-22 — — US disclosed
EP-3170504-A1 METHOD FOR PRODUCING LIPID PARTICLE AND NUCLEIC ACID DELIVERY CARRIER COMPRISING LIPID PARTICLE Fujifilm Corporation (JP) 2017-05-24 — — EP disclosed
US-20170121714-A1 METHOD FOR PRODUCING LIPID PARTICLES AND NUCLEIC ACID DELIVERY CARRIER HAVING LIPID PARTICLES FUJIFILM CORPORATION (JP) 2017-05-04 — — US disclosed
US-20170119887-A1 LIPID PARTICLES AND NUCLEIC ACID DELIVERY CARRIER FUJIFILM CORPORATION (JP) 2017-05-04 — — US disclosed
US-8362015-B2 Aminoacyl prodrug derivatives and medicaments for treatment of thromboembolic disorders BAYER INTELLECTUAL PROPERTY GMBH (DE) 2013-01-29 — — US disclosed
EP-2084154-B1 AMINOACYL PRODRUG DERIVATIVES AND MEDICAMENTS FOR TREATMENT OF THROMBOEMBOLIC DISORDERS BAYER IP GMBH (DE) 2012-11-21 — — EP disclosed
US-20100292230-A1 Aminoacyl prodrug derivatives and medicaments for treatment of thromboembolic disorders BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2010-11-18 — — US disclosed
EP-2084154-A1 AMINOACYL PRODRUG DERIVATIVES AND MEDICAMENTS FOR TREATMENT OF THROMBOEMBOLIC DISORDERS Bayer Schering Pharma Aktiengesellschaft (DE) 2009-08-05 — — EP disclosed
WO-2008022786-A1 AMINOACYL PRODRUG DERIVATIVES AND MEDICAMENTS FOR TREATMENT OF THROMBOEMBOLIC DISORDERS BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2008-02-28 — — 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 (6 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-20170121714-A1 METHOD FOR PRODUCING LIPID PARTICLES AND NUCLEIC ACID DELIVERY CARRIER HAVING LIPID PARTICLES LIPA, LIPC, POLR2H KLK7 1811/4885SCN9A 2911/4885CYP3A4 2085/4885
US-20230357312-A1 Borylated Di-Peptide Amino Acid compositions for use in Boron Neutron Capture Therapy and methods thereof NPPA, BCAT2, BCAT1 KLK7 1184/4885SCN9A 1262/4885CYP3A4 4508/4885
US-20240026051-A1 CATIONIC CYCLIC AMINE AND AMPHIPATHIC TRANSFECTION REAGENTS SLC7A1, PARN, PARG KLK7 3249/4885SCN9A 3417/4885CYP3A4 4858/4885
US-20170119887-A1 LIPID PARTICLES AND NUCLEIC ACID DELIVERY CARRIER NPC1, NPC1L1, LDLR KLK7 2950/4885SCN9A 3407/4885CYP3A4 4422/4885
US-20100292230-A1 Aminoacyl prodrug derivatives and medicaments for treatment of thromboembolic disorders AADAC, AADAT, DNPEP KLK7 4392/4885SCN9A 3029/4885CYP3A4 175/4885
US-11739174-B2 Cationic cyclic amine and amphipathic transfection reagents SLC7A1, PARN, PARG KLK7 3249/4885SCN9A 3417/4885CYP3A4 4858/4885

“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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