SCHEMBL1741945

SCHEMBL1741945

C=CC(N)I

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
SCHEMBL5759005 1.00
SCHEMBL1170801 0.70
SCHEMBL87668 0.70
SCHEMBL8148014 0.67
SCHEMBL1485693 0.67
SCHEMBL3593914 0.67
Hydrochloric Acid SCHEMBL5861361 0.67
SCHEMBL9728681 0.64
Ammonia Solution, Strong SCHEMBL11186815 0.64
SCHEMBL175049 0.64

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111518044-A Alkoxy isoxazole derivative and preparation method and application thereof 华东师范大学 2020-08-11 CN disclosed
US-20200223871-A1 Arginase Inhibitors and Methods of Use ASTRAZENECA AB (SE) 2020-07-16 US disclosed
EP-2389352-B1 ARGINASE INHIBITORS AND METHODS OF USE UNIV PENNSYLVANIA (US) 2019-05-08 EP disclosed
US-20190127395-A1 Arginase Inhibitors and Methods of Use ASTRAZENECA AB (SE) 2019-05-02 US disclosed
US-10118936-B2 Arginase inhibitors and methods of use THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2018-11-06 US disclosed
US-20160194340-A1 ARGINASE INHIBITORS AND METHODS OF USE UNIV PENNSYLVANIA (US) 2016-07-07 US disclosed
EP-2389352-A2 ARGINASE INHIBITORS AND METHODS OF USE The Trustees Of The University Of Pennsylvania (US) 2011-11-30 EP disclosed
US-8040818-B2 Method for exchange of upkeep-relevant information with a computer-supported, upkeep system ENDRESS + HAUSER PROCESS SOLUTIONS AG (CH) 2011-10-18 US disclosed
US-20100189644-A1 ARGINASE INHIBITORS AND METHODS OF USE THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2010-07-29 US disclosed
WO-2010085797-A2 ARGINASE INHIBITORS AND METHODS OF USE THE TRUSTEES OF UNIVERSITY OF PENNSYLVANIA (US) 2010-07-29 WO disclosed
EP-1572197-A1 4- 1- (SULFONYL) -1H-INDOL-2-YL)-4- (HYDROXY) -CYCLOHEXA-2,5-DIENONE COMPOUNDS AND ANALOGS THEREOF AS THERAPEUTIC AGENTS Cancer Research Technology Limited (GB) 2005-09-14 EP disclosed
EP-1023315-A4 METHODS AND COMPOSITIONS FOR DESTRUCTION OF SELECTED PROTEINS SLOAN KETTERING INSTITUTEFOR C (US) 2004-12-29 EP disclosed
WO-2004056361-A1 4-(1-(SULFONYL)-1H-INDOL-2-YL)-4-(HYDROXY)-CYCLOHEXA-2,5-DIENONE COMPOUNDS AND ANALOGS THEREOF AS THERAPEUTIC AGENTS CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2004-07-08 WO disclosed
US-6670348-B1 Antitumor geldanamycins SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH 2003-12-30 US disclosed
EP-1023315-A1 METHODS AND COMPOSITIONS FOR DESTRUCTION OF SELECTED PROTEINS Sloan-Kettering Institute For Cancer Research (US) 2000-08-02 EP disclosed
WO-1998051702-A1 METHODS AND COMPOSITIONS FOR DESTRUCTION OF SELECTED PROTEINS SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) 1998-11-19 WO disclosed
US-5510475-A ATTACHMENT OF REPORTERS BY WAY OF PHOSPHONAMIDATE LINKERS, HAVING PROTECTED HYDROXYL OR AMINO FUNCTIONALITY HYBRIDON, INC. (US) 1996-04-23 US disclosed
EP-0556301-A1 INCORPORATION OF MULTIPLE REPORTER GROUPS ON SYNTHETIC OLIGONUCLEOTIDES HYBRIDON, Inc. (US) 1993-08-25 EP disclosed
WO-1992008728-A1 INCORPORATION OF MULTIPLE REPORTER GROUPS ON SYNTHETIC OLIGONUCLEOTIDES HYBRIDON, INC. (US) 1992-05-29 WO disclosed
US-4756998-A Ethylenically unsaturated complex containing at least one urethane or urea group AGFA GEVAERT AKTIENGESELLSCHAFT (DE) 1988-07-12 US disclosed