SCHEMBL1136775

SCHEMBL1136775

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

nearest known ligand 0.43

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
NOS1 P29475 2/20 0.43
NOS3 P29474 1/20 0.43
NOS2 P35228 1/20 0.43
DGAT1 O75907 1/20 0.30

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
SCHEMBL1136772 1.00 NOS1 (0.43) NOS1NOS3NOS2DGAT1
SCHEMBL12317214 1.00 NOS1 (0.43) NOS1NOS3NOS2DGAT1
SCHEMBL8812889 0.80 DGAT1 (0.32) NOS1NOS3NOS2DGAT1
SCHEMBL875384 0.80 NOS1 (0.32) NOS1NOS3NOS2
SCHEMBL320541 0.78 DGAT1 (0.34) NOS1NOS3NOS2DGAT1
SCHEMBL8974211 0.77 DGAT1 (0.31) NOS1NOS3NOS2DGAT1
SCHEMBL12146973 0.77 DGAT1 (0.31) NOS1NOS3NOS2DGAT1
SCHEMBL8134503 0.76
SCHEMBL17348031 0.76 DGAT1 (0.33) DGAT1
SCHEMBL11247187 0.76

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024032799-A1 Preparation Method of Tetrodotoxin and its Analog NATIONAL INSTITUTE OF BIOLOGICAL SCIENCES, BEIJING (CN) 2024-02-15 WO claimed
CN-113301926-A Compounds targeting norepinephrine transporters 广州市迈飞医学科技有限公司 2021-08-24 CN claimed
WO-2011156355-A1 PRODUCTION METHOD OF PHENYL GUANIDINE SALTS AND THEIR INTERMEDIATES KAINOS MEDICINE, INC. (KR) 2011-12-15 WO claimed
US-20060172927-A1 Analogs of human growth hormone-releasing hormone, their preparation and use INSTYTUT FARMACEUTYCZNY (PL) 2006-08-03 US claimed
EP-3877439-B1 ANALGESIC AND ANTI-ADDICTIVE COMPOSITIONS FOR TREATMENT OF CHRONIC PAIN AND OPIOID ADDICTION UNIV MINNESOTA (US) 2026-03-11 EP disclosed
US-20240092731-A1 CREATINE PRODRUGS, COMPOSITIONS AND METHODS OF USE THEREOF ULTRAGENYX PHARMACEUTICAL INC. 2024-03-21 US disclosed
WO-2024032799-A1 Preparation Method of Tetrodotoxin and its Analog NATIONAL INSTITUTE OF BIOLOGICAL SCIENCES, BEIJING (CN) 2024-02-15 WO disclosed
CN-111757883-B Novel inhibitors of bacterial glutaminyl cyclase for the treatment of periodontal disease and related diseases 弗劳恩霍夫应用研究促进协会 2024-02-13 CN disclosed
US-11753369-B2 Creatine prodrugs, compositions and methods of use thereof ULTRAGENYX PHARMACEUTICAL INC. (US) 2023-09-12 US disclosed
CN-110167926-B Poly-ADP ribose polymerase (PARP) inhibitors 米托布里奇公司 2022-09-13 CN disclosed
US-20220227703-A1 CREATINE PRODRUGS, COMPOSITIONS AND METHODS OF USE THEREOF ULTRAGENYX PHARMACEUTICAL INC. 2022-07-21 US disclosed
US-11332438-B2 Creatine prodrugs, compositions and methods of use thereof ULTRAGENYX PHARMACEUTICAL INC. (US) 2022-05-17 US disclosed
WO-1999007685-A1 ANTIBIOTIC FOR METHICILLIN RESISTANT BACTERIA RESEARCH CORPORATION TECHNOLOGIES, INC. (US) 1999-02-18 WO disclosed
WO-1998054164-A1 SULFONAMIDE DERIVATIVES, THEIR PRODUCTION AND USE TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1998-12-03 WO disclosed
EP-0804431-A4 GLYCOPROTEIN IIb/IIIa ANTAGONISTS LILLY CO ELI (US) 1998-04-29 EP disclosed
WO-1998005961-A1 COMPOUNDS HAVING A PLURALITY OF NITROGENOUS SUBSTITUENTS ISIS PHARMACEUTICALS, INC. (US) 1998-02-12 WO disclosed
WO-1997047194-A1 SUBSTITUTED CYCLOPENTANE COMPOUNDS USEFUL AS NEURAMINIDASE INHIBITORS BIOCRYST PHARMACEUTICALS, INC. (US) 1997-12-18 WO disclosed
EP-0804431-A1 GLYCOPROTEIN IIb/IIIa ANTAGONISTS ELI LILLY AND COMPANY (US) 1997-11-05 EP disclosed
WO-1997030073-A1 SERINE PROTEASE INHIBITORS AKZO NOBEL N.V. (NL) 1997-08-21 WO disclosed
EP-0789708-A1 MULTIFUNCTIONAL MOLECULAR COMPLEXES FOR GENE TRANSFER TO CELLS APOLLON, INC. (US) 1997-08-20 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 (4 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-11332438-B2 Creatine prodrugs, compositions and methods of use thereof CKMT1A; CKMT1B, PYGM, TKT NOS1 3908/4885NOS3 3698/4885NOS2 3984/4885
US-20240092731-A1 CREATINE PRODRUGS, COMPOSITIONS AND METHODS OF USE THEREOF CKMT1A; CKMT1B, PYGM, TKT NOS1 3908/4885NOS3 3698/4885NOS2 3984/4885
US-11753369-B2 Creatine prodrugs, compositions and methods of use thereof CKMT1A; CKMT1B, PYGM, TKT NOS1 3908/4885NOS3 3698/4885NOS2 3984/4885
US-20220227703-A1 CREATINE PRODRUGS, COMPOSITIONS AND METHODS OF USE THEREOF CKMT1A; CKMT1B, PYGM, TKT NOS1 3908/4885NOS3 3698/4885NOS2 3984/4885

“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.