SCHEMBL178798

SCHEMBL178798

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

nearest known ligand 0.67

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.67
EPHX2 P34913 1/20 0.54
CASP3 P42574 2/20 0.51
FABP5 Q01469 3/20 0.50
FABP7 O15540 2/20 0.50
OPRD1 P41143 1/20 0.50
MDM4 O15151 1/20 0.46
TP53 P04637 1/20 0.46

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
SCHEMBL29352060 1.00 KMT2A (0.67) KMT2AEPHX2CASP3FABP5FABP7
SCHEMBL29443815 1.00 KMT2A (0.67) KMT2AEPHX2CASP3FABP5FABP7
SCHEMBL30125177 1.00 KMT2A (0.67) KMT2AEPHX2CASP3FABP5FABP7
Fluoride SCHEMBL7156257 0.98 KMT2A (0.66) KMT2AEPHX2CASP3FABP5FABP7
Biphenyl SCHEMBL2720981 0.96 KMT2A (0.63) KMT2AEPHX2CASP3FABP5FABP7
SCHEMBL30877982 0.94 KMT2A (0.62) KMT2AEPHX2CASP3FABP5FABP7
SCHEMBL31309934 0.94 KMT2A (0.62) KMT2AEPHX2CASP3FABP5FABP7
SCHEMBL31309880 0.94 KMT2A (0.62) KMT2AEPHX2CASP3FABP5FABP7
SCHEMBL1667739 0.94 KMT2A (0.62) KMT2AEPHX2CASP3FABP5FABP7
SCHEMBL31309913 0.94 KMT2A (0.62) KMT2AEPHX2CASP3FABP5FABP7

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 1153 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-122036845-A Cathepsin B-sensitive fatty acid-doxorubicin prodrug, albumin nanoparticle thereof, and preparation method and application thereof 沈阳药科大学 2026-05-15 CN claimed
CN-119219731-A Ganjing two drugs Process for producing peptide 常州吉恩药业有限公司 2024-12-31 CN claimed
CN-118374277-A Double-protease activated chemiluminescent probe and preparation method and application thereof 复旦大学 2024-07-23 CN claimed
CN-118005719-A SIRP alpha blocker polypeptide, construction method and application thereof 华东理工大学 2024-05-10 CN claimed
CN-117924669-A Carboxyl functionalized super-crosslinked polymer and preparation method and application thereof 中南民族大学 2024-04-26 CN claimed
WO-2024017317-A1 HER2 TARGETING PEPTIDE MOLECULE AND USE THEREOF 中国科学院上海药物研究所 2024-01-25 WO claimed
CN-117430670-A HER2 targeting peptide molecule and application thereof 中国科学院上海药物研究所 2024-01-23 CN claimed
CN-117343127-A Targeted antitumor prodrug, and preparation method and application thereof 中国科学技术大学 2024-01-05 CN claimed
CN-116999408-A Cathepsin B-sensitive fatty acid-doxorubicin prodrug, albumin nanoparticle thereof, preparation method and application 沈阳药科大学 2023-11-07 CN claimed
CN-112430588-B Short peptide for resisting novel coronavirus infection and preparation method and application thereof 中国人民解放军陆军军医大学 2022-12-30 CN claimed
CN-112430588-A Short peptide for resisting novel coronavirus infection and preparation method and application thereof 中国人民解放军陆军军医大学 2021-03-02 CN claimed
CN-112110834-A Modified hydrophobic auxiliary material and preparation method and application thereof 浙江智达药业有限公司 2020-12-22 CN claimed
CN-106048736-B A kind of method of synthesis in solid state DNA encoding compound library 成都先导药物开发股份有限公司 2019-09-03 CN claimed
CN-109701013-A A kind of targeted nanometer drug delivery system and preparation method 安徽工程大学 2019-05-03 CN claimed
CN-108373496-A Inoxidizability polypeptide GTMGAVGPRG and preparation method thereof 安徽工程大学 2018-08-07 CN claimed
CN-105440110-A Chemical synthetic method for anti-inflammatory cyclopeptide cyclosquamosin D SHANGHAI ABBIOCHEM COMPANY LTD 2016-03-30 CN claimed
CN-102775471-B Method for synthesizing cholecystokinin octapeptide by combining solid phase method and liquid phase method GL BIOCHEM SHANGHAI CO LTD 2013-10-30 CN claimed
WO-2013130461-A1 WEE1 DEGRADATION INHIBITORS THE SCRIPPS RESEARCH INSTITUTE (US) 2013-09-06 WO claimed
CN-101224306-B Folic acid-polypeptide compound-mediated targeting anti-tumor prodrug and preparing method thereof UNIV SUN YAT SEN 2011-04-20 CN claimed
CN-101230089-A Solid-phase synthesis of glycyl histidyl lycine GL BIOCHEM SHANGHAI LTD (CN) 2008-07-30 CN claimed