SCHEMBL4363673

SCHEMBL4363673

O=C(N[C@H](CS)C(=O)O)C(O)CO

nearest known ligand 0.58

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ACE P12821 1/20 0.58
KDM4E B2RXH2 1/20 0.53
MAPT P10636 1/20 0.53
THRB P10828 1/20 0.53
ALOX15 P16050 1/20 0.53
NFKB1 P19838 1/20 0.53
PTGS2 P35354 1/20 0.53
THPO P40225 1/20 0.53
RECQL P46063 1/20 0.53
BLM P54132 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
FOLH1 Q04609 1/20 0.46
OR51E2 Q9H255 1/20 0.44
MME P08473 7/20 0.44
TGFBR1 P36897 3/20 0.38
CA1 P00915 1/20 0.37
CA2 P00918 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
SCHEMBL321602 1.00 ACE (0.58) ACEKDM4EMAPTTHRBALOX15
SCHEMBL8216927 1.00 ACE (0.58) ACEKDM4EMAPTTHRBALOX15
SCHEMBL6253538 0.91 ACE (0.49) ACEKDM4EMAPTTHRBALOX15
SCHEMBL2633846 0.89 ACE (0.47) ACEKDM4EMAPTTHRBALOX15
SCHEMBL7070376 0.85 TGFBR1 (0.52) ACEFOLH1OR51E2MMETGFBR1
SCHEMBL6009831 0.85 TGFBR1 (0.52) ACEFOLH1OR51E2MMETGFBR1
SCHEMBL8491732 0.80 OR51E2 (0.44) ACEFOLH1OR51E2MMETGFBR1
SCHEMBL29837094 0.80 OR51E2 (0.44) ACEKDM4EMAPTTHRBALOX15
SCHEMBL28806122 0.80 OR51E2 (0.44) ACEKDM4EMAPTTHRBALOX15
SCHEMBL8491734 0.80 OR51E2 (0.44) ACEFOLH1OR51E2MMETGFBR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3515476-B1 FUSION COMPRISING A CELL PENETRATING PEPTIDE, A MULTIEPITOPE AND A TLR PEPTIDE AGONIST FOR TREATMENT OF CANCER AMAL THERAPEUTICS SA (CH) 2024-05-22 EP disclosed
EP-3429618-B1 COMBINATION OF AN IMMUNE CHECKPOINT MODULATOR AND A COMPLEX COMPRISING A CELL PENETRATING PEPTIDE, A CARGO AND A TLR PEPTIDE AGONIST FOR USE IN MEDICINE AMAL THERAPEUTICS SA (CH) 2024-02-21 EP disclosed
EP-3693009-B1 A NOVEL COMPLEX COMPRISING A CELL PENETRATING PEPTIDE, A CARGO AND A TLR PEPTIDE AGONIST FOR TREATMENT OF COLORECTAL CANCER AMAL THERAPEUTICS SA (CH) 2024-02-21 EP disclosed
EP-4228681-A1 COMBINATION OF A STING AGONIST AND A COMPLEX COMPRISING A CELL PENETRATING PEPTIDE, A CARGO AND A TLR PEPTIDE AGONIST Boehringer Ingelheim International GmbH (DE) 2023-08-23 EP disclosed
EP-4210734-A1 HETEROLOGOUS PRIME BOOST VACCINE Boehringer Ingelheim International GmbH (DE) 2023-07-19 EP disclosed
US-20230035037-A1 TEIPP PEPTIDE VARIANT AND USES THEREOF ACADEMISCH ZIEKENHUIS LEIDEN (h.o.d.n. LUMC) (NL) 2023-02-02 US disclosed
US-20220175933-A1 Novel Complex Comprising A Cell Penetrating Peptide, A Cargo And A TLR Peptide Agonist For Treatment Of Glioblastoma AMAL THERAPEUTICS SA (CH) 2022-06-09 US disclosed
US-11338027-B2 Fusion comprising a cell penetrating peptide, a multi epitope and a TLR peptide agonist for treatment of cancer AMAL THERAPEUTICS SA (CH) 2022-05-24 US disclosed
WO-2022079175-A1 COMBINATION OF A STING AGONIST AND A COMPLEX COMPRISING A CELL PENETRATING PEPTIDE, A CARGO AND A TLR PEPTIDE AGONIST BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2022-04-21 WO disclosed
US-20220118102-A1 COMBINATION OF AN IMMUNE CHECKPOINT MODULATOR AND A COMPLEX COMPRISING A CELL PENETRATING PEPTIDE, A CARGO AND A TLR PEPTIDE AGONIST FOR USE IN MEDICINE AMAL THERAPEUTICS SA (CH) 2022-04-21 US disclosed
EP-2732825-B1 Conjugates of a TLR7 and/or TLR8 agonist and a TLR2 agonist INVIVOGEN (FR) 2015-07-01 EP disclosed
US-20140242108-A1 Conjugated TLR7 and/or TLR8 and TLR2 polycationic agonists CAYLA (FR) 2014-08-28 US disclosed
EP-2769738-A1 Conjugated TLR7 and/or TLR8 and TLR2 polycationic agonists Invivogen (FR) 2014-08-27 EP disclosed
US-20140141033-A1 CONJUGATED TLR7 AND/OR TLR8 AND TLR2 AGONISTS CAYLA (FR) 2014-05-22 US disclosed
EP-2732825-A1 Conjugated TLR7 and/or TLR8 and TLR2 agonists Invivogen (FR) 2014-05-21 EP disclosed
WO-2009137103-A2 ANTI-CANCER/ANTI-VIRAL COMPOUNDS AND METHODS OF USE OURTH DONALD D (US) 2009-11-12 WO disclosed
US-6074650-A INDUCTION OF CYTOTOXIC LYMPHOCYTES HOECHST AKTIENGESELLSCHAFT (DE) 2000-06-13 US disclosed
US-6024964-A ANTIBODIES AND ANTIGENS WITH MEMBRANE ANCHORING HOECHST AKTIENGESELLSCHAFT (DE) 2000-02-15 US disclosed
EP-0210412-B1 Anchoring membrane ingredient conjugate, and its use HOECHST AG (DE) 1995-12-13 EP disclosed
EP-0210412-A2 Anchoring membrane ingredient conjugate, and its use HOECHST AKTIENGESELLSCHAFT (DE) 1987-02-04 EP 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 (2 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-20140141033-A1 CONJUGATED TLR7 AND/OR TLR8 AND TLR2 AGONISTS TLR7, TLR8, TLR9 ACE 4600/4885KDM4E 1468/4885MAPT 3375/4885
US-20140242108-A1 Conjugated TLR7 and/or TLR8 and TLR2 polycationic agonists TLR7, TLR8, TLR9 ACE 4793/4885KDM4E 1683/4885MAPT 4031/4885

“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.