SCHEMBL2045337

SCHEMBL2045337

CCCCCN=N

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL10395574 0.97 TSHR (0.50)
SCHEMBL6441826 0.97
SCHEMBL10036756 0.97 TSHR (0.50)
SCHEMBL13356338 0.97
SCHEMBL15450555 0.97 TSHR (0.50)
SCHEMBL23921312 0.97 TSHR (0.50)
SCHEMBL9309570 0.97 TSHR (0.50)
SCHEMBL4886229 0.97 TSHR (0.50)
SCHEMBL17873397 0.97 TSHR (0.50)
SCHEMBL10623843 0.97 TSHR (0.50)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105899072-A Disinfectant composition 怀特利集团控股有限公司 2016-08-24 CN claimed
EP-2516555-A2 COLORING AGENTS AND METHODS OF USE THEREOF Living Proof, Inc. (US) 2012-10-31 EP claimed
WO-2011084803-A2 COLORING AGENTS AND METHODS OF USE THEREOF LIVING PROOF, INC. (US) 2011-07-14 WO claimed
US-20110154583-A1 COLORING AGENTS AND METHODS OF USE THEREOF LIVING PROOF, INC. (US) 2011-06-30 US claimed
US-7414106-B2 Synthesis of peptide α-thioesters LAWRENCE LIVERMORE NATIONAL SECURITY, LLC (US) 2008-08-19 US claimed
US-20070129537-A1 Synthesis of peptide alpha-thioesters THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2007-06-07 US claimed
CN-117425656-A Purine derivatives as anticancer agents 探戈医药股份有限公司 2024-01-19 CN disclosed
CN-111032046-B Pyruvate kinase modulators and uses thereof 安吉奥斯医药品有限公司 2023-09-26 CN disclosed
CN-116568677-A piperidin-1-yl-N-pyridin-3-yl-2-oxoacetamide derivatives useful for the treatment of MTAP deficiency and/or MTA accumulating cancers 探戈医药股份有限公司 2023-08-08 CN disclosed
EP-4180804-A1 ELECTROCHEMICAL SENSORS MADE OF PLASMA TREATED POLYLACTIC ACID (PLA) Universitat Politècnica De Catalunya (ES) 2023-05-17 EP disclosed
CN-111032046-A Pyruvate kinase modulators and uses thereof 安吉奥斯医药品有限公司 2020-04-17 CN disclosed
US-10358445-B2 Respiratory formulations and compounds for use therein Respivert, Ltd. (GB) 2019-07-23 US disclosed
US-10065976-B2 Titanium (IV) compounds and methods of forming heterocyclic compounds using same REGENTS OF THE UNIVERSITY OF MINNESOTA (US) 2018-09-04 US disclosed
US-20070206912-A1 APPARATUS AND METHOD FOR A WAVEGUIDE WITH AN INDEX PROFILE MANIFESTING A CENTRAL DIP FOR BETTER ENERGY EXTRACTION ACULIGHT CORPORATION (US) 2007-09-06 US disclosed
US-7244644-B2 Undercut and residual spacer prevention for dual stressed layers INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2007-07-17 US disclosed
US-20070142285-A1 Methods of Treatment and Uses for CaMKII and Its Interaction with HDACs and Calpain THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM 2007-06-21 US disclosed
US-20070129537-A1 Synthesis of peptide alpha-thioesters THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2007-06-07 US disclosed
US-20070129537-A1 Synthesis of peptide alpha-thioesters THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2007-06-07 US disclosed
US-20070020625-A1 Sequence of the photorhabdus luminescens strain tt01 genome and uses DUCHAUD ERIC 2007-01-25 US disclosed
US-20070020838-A1 UNDERCUT AND RESIDUAL SPACER PREVENTION FOR DUAL STRESSED LAYERS INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2007-01-25 US disclosed