SCHEMBL3440738

SCHEMBL3440738

O=C1C=CC=[C]C1

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
SCHEMBL740773 0.72
SCHEMBL3572806 0.68
SCHEMBL4238033 0.67
SCHEMBL9252865 0.67
SCHEMBL4193817 0.62
SCHEMBL8631243 0.62
SCHEMBL7173551 0.62
SCHEMBL17301151 0.57 ALDH1A1 (0.41)
SCHEMBL2187730 0.55
SCHEMBL2969964 0.54

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 15 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130040056-A1 HETEROLEPTIC IRIDIUM PRECURSORS TO BE USED FOR THE DEPOSITION OF IRIDIUM-CONTAINING FILMS L'AIR LIQUIDE, SOCIETE ANONYME POUR L'ETUDE ET L'EXPLOITATION DES PROCEDES GEORGES CLAUDE (FR) 2013-02-14 US claimed
US-20090258144-A1 Heteroleptic Iridium Precursors To Be Used For The Deposition Of Iridium-Containing Films AMERICAN AIR LIQUIDE, INC. (US) 2009-10-15 US claimed
CN-1121806-A Pharmaceutical agents for treatment of emesis PFIZER (US) 1996-05-08 CN claimed
EP-1887102-B1 PRECURSORS HAVING OPEN LIGANDS FOR RUTHENIUM CONTAINING FILMS DEPOSITION AIR LIQUIDE (FR) 2020-04-08 EP disclosed
US-20160318897-A1 AZOLE COMPOUNDS CARRYING AN IMINE-DERIVED SUBSTITUENT BASF SE (DE) 2016-11-03 US disclosed
US-8658249-B2 Heteroleptic iridium precursors to be used for the deposition of iridium-containing films L'Air Liquide, SociétéAnonyme pour l'Etude et l'Exploitation des Procédés Georges Claude (FR) 2014-02-25 US disclosed
US-20130040056-A1 HETEROLEPTIC IRIDIUM PRECURSORS TO BE USED FOR THE DEPOSITION OF IRIDIUM-CONTAINING FILMS L'AIR LIQUIDE, SOCIETE ANONYME POUR L'ETUDE ET L'EXPLOITATION DES PROCEDES GEORGES CLAUDE (FR) 2013-02-14 US disclosed
US-8309174-B2 Heteroleptic iridium precursors to be used for the deposition of iridium-containing films L'AIR LIQUIDE SOCIETE ANONYME POUR L'ETUDE ET L'EXPLOITATION DES PROCEDES GEORGES CLAUDE (FR) 2012-11-13 US disclosed
US-7807223-B2 Precursors having open ligands for ruthenium containing films deposition L'AIR LIQUIDE SOCIETE ANONYME POUR L'ETUDE ET L'EXPLOITATION DES PROCEDES GEORGES CLAUDE (FR) 2010-10-05 US disclosed
US-20090258144-A1 Heteroleptic Iridium Precursors To Be Used For The Deposition Of Iridium-Containing Films AMERICAN AIR LIQUIDE, INC. (US) 2009-10-15 US disclosed
US-20080107812-A1 PRECURSORS HAVING OPEN LIGANDS FOR RUTHENIUM CONTAINING FILMS DEPOSITION L'AIR LIQUIDE, SOCIETE ANONYME POUR I'ETUDE ET I'EXPLOITATION DES PROCEDES GEORGES CLAUDE (FR) 2008-05-08 US disclosed
EP-1887102-A1 Precursors having open ligands for ruthenium containing films deposition L'AIR LIQUIDE, Société Anonyme pour l'Etude et l'Exploitation des Procédés Georges Claude (FR) 2008-02-13 EP disclosed
CN-1100535-C Pharmaceutical agents for treatment of emesis PFIZER (US) 2003-02-05 CN disclosed
CN-1121806-A Pharmaceutical agents for treatment of emesis PFIZER (US) 1996-05-08 CN disclosed
EP-0430004-A2 1,8-Naphthalimides as antidotes BASF Aktiengesellschaft (DE) 1991-06-05 EP disclosed