SCHEMBL178760

SCHEMBL178760

O=C(O)CCCCCCCCCCCNC(=O)OCC1c2ccccc2-c2ccccc21

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 1.00
HTT P42858 1/20 0.52
EPHX2 P34913 1/20 0.48
CASP3 P42574 2/20 0.46
HTR2C P28335 1/20 0.45
SLC6A3 Q01959 1/20 0.45
MAPK1 P28482 1/20 0.44
FABP7 O15540 1/20 0.44
FABP5 Q01469 1/20 0.44
TLR2 O60603 1/20 0.43
TLR1 Q15399 1/20 0.43

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
SCHEMBL178895 1.00 KMT2A (1.00) KMT2AHTTEPHX2CASP3HTR2C
SCHEMBL25143 1.00 KMT2A (1.00) KMT2AHTTEPHX2CASP3HTR2C
SCHEMBL178890 1.00 KMT2A (1.00) KMT2AHTTEPHX2CASP3HTR2C
SCHEMBL2182769 1.00 KMT2A (1.00) KMT2AHTTEPHX2CASP3HTR2C
SCHEMBL17746959 1.00 KMT2A (1.00) KMT2AHTTEPHX2CASP3HTR2C
SCHEMBL178762 1.00 KMT2A (1.00) KMT2AHTTEPHX2CASP3HTR2C
SCHEMBL178759 1.00 KMT2A (1.00) KMT2AHTTEPHX2CASP3HTR2C
SCHEMBL178761 1.00 KMT2A (1.00) KMT2AHTTEPHX2CASP3HTR2C
SCHEMBL178758 1.00 KMT2A (1.00) KMT2AHTTEPHX2CASP3HTR2C
SCHEMBL178892 1.00 KMT2A (1.00) KMT2AHTTEPHX2CASP3HTR2C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-122011102-A Cyclic peptide ligand of target asialoglycoprotein receptor, pharmaceutically acceptable salt thereof and application and pharmaceutical composition thereof 浙江大学 2026-05-12 CN disclosed
US-20260117106-A1 ANTI-FREEZE COMPOSITION BASED ON 2D AMPHIPHILIC PEPTIDE NANOSTRUCTURES GWANGJU INST SCIENCE & TECH (KR) 2026-04-30 US disclosed
CN-118028329-A Preparation method and application of xanthomonas oryzae NuoEF complex protein crystal 江苏省中国科学院植物研究所 2024-05-14 CN disclosed
EP-4305162-A1 MICELLAR CATALYSIS University of Newcastle Upon Tyne (GB) 2024-01-17 EP disclosed
CN-116964200-A Micelle catalysis 泰恩河畔纽卡斯尔大学 2023-10-27 CN disclosed
CN-112851755-B Linear lipopeptide compound and preparation method and application thereof 中国人民解放军军事科学院军事医学研究院 2023-09-01 CN disclosed
CN-114763369-A Aliphatic peptide chain and Fab-aliphatic chain conjugate 正大天晴药业集团股份有限公司 2022-07-19 CN disclosed
CN-113615700-A Application of parthenolide derivative in prevention and treatment of bacterial blight of rice 江苏省中国科学院植物研究所 2021-11-09 CN disclosed
CN-107522779-B Polypeptide having sugar chain attached thereto and pharmaceutical composition containing the same 株式会社糖锁工学研究所 2021-10-26 CN disclosed
CN-112851755-A Linear lipopeptide compound and preparation method and application thereof 中国人民解放军军事科学院军事医学研究院 2021-05-28 CN disclosed
WO-2005000878-A2 COMPOSITIONS OF LIPOPEPTIDE ANTIBIOTIC DERIVATIVES AND METHODS OF USE THEREOF MIGENIX INC. (CA) 2005-01-06 WO disclosed
WO-2004099774-A2 PROCESSES FOR THE IDENTIFICATION OF MEDICAL TARGETS BY SCREENING AN ACTIVE AGENT FOR BINDING INTERACTIONS CELLZOME AG (DE) 2004-11-18 WO disclosed
WO-2004031405-A1 SUBSTRATES FOR O6-ALKYLGUANINE-DNA ALKYLTRANSFERASE ECOLE POLYTECHNIQUE FEDERALE DE LAUSANNE (EPFL) (CH) 2004-04-15 WO disclosed
US-6664231-B1 Based on Domain III (amino acids 142-169) of bactericidal/ permeability-increasing protein; candida, aspergillus, cryptococcus XOMA CORPORATION 2003-12-16 US disclosed
US-6156730-A Anti-fungal peptides XOMA CORPORATION (US) 2000-12-05 US disclosed
US-5858974-A BACTERICIDAL/PERMEABILITY INCREASING PROTEIN XOMA CORPORATION (US) 1999-01-12 US disclosed
EP-0839156-A1 ANTI-FUNGAL PEPTIDES Xoma Corporation (US) 1998-05-06 EP disclosed
WO-1997004008-A1 ANTI-FUNGAL PEPTIDES XOMA CORPORATION (US) 1997-02-06 WO disclosed
EP-0541663-A1 PEPTIDES AND PHARMACEUTICAL COMPOSITIONS HAVING GLYCOPROTEIN HORMONE AGONISTIC OR ANTAGONISTIC ACTIVITY STICHTING CENTRAAL DIERGENEESKUNDIG INSTITUUT (NL) 1993-05-19 EP disclosed
WO-1992002542-A1 PEPTIDES AND PHARMACEUTICAL COMPOSITIONS HAVING GLYCOPROTEIN HORMONE AGONISTIC OR ANTAGONISTIC ACTIVITY STICHTING CENTRAAL DIERGENEESKUNDIG INSTITUUT (NL) 1992-02-20 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 (1 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-20260117106-A1 ANTI-FREEZE COMPOSITION BASED ON 2D AMPHIPHILIC PEPTIDE NANOSTRUCTURES YBX1, MAFK, MEF2D KMT2A 3627/4885HTT 2632/4885EPHX2 4733/4885

“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.