SCHEMBL4473168

SCHEMBL4473168

N#CCNCCNC=O

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
SCHEMBL505679 0.81 ALDH1A1 (0.38)
SCHEMBL1759861 0.78
SCHEMBL4473045 0.78 ADH1B (0.39)
SCHEMBL12921486 0.78 CA12 (0.36)
SCHEMBL14388744 0.74 ADH1B (0.56)
SCHEMBL3197403 0.74
SCHEMBL211319 0.74
SCHEMBL12391588 0.73 TSHR (0.38)
SCHEMBL30080118 0.72
Methane SCHEMBL28714950 0.72

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2751069-B1 METHOD FOR PRODUCING EDDN AND/OR EDMN BASF SE (DE) 2017-10-11 EP disclosed
US-9096497-B2 Process for preparing EDDN and EDMN BASF SE (DE) 2015-08-04 US disclosed
US-8952156-B2 Process for working up reaction outputs from the hydrogenation of EDDN or EDMN BASF SE (DE) 2015-02-10 US disclosed
US-8946459-B2 Process for preparing EDDN and/or EDMN by reacting EDFA and/or EDMFA with HCN BASF SE (DE) 2015-02-03 US disclosed
US-20130090453-A1 Process for preparing TETA and DETA BASF SE (DE) 2013-04-11 US disclosed
US-20130085286-A1 Unknown BASF SE (DE) 2013-04-04 US disclosed
US-20130079492-A1 PROCESS FOR PREPARING EDDN AND EDMN BASF SE (DE) 2013-03-28 US disclosed
WO-2013030258-A1 METHOD FOR PROCESSING REACTION PRODUCT STEMMING FROM THE HYDROGENATION OF EDDN OR EDMN BASF SE (DE) 2013-03-07 WO disclosed
US-7572924-B2 Pyrrole substituted 2-indolinone protein kinase inhibitors SUGEN, INC. (US) 2009-08-11 US disclosed
US-7320996-B2 Indolinone protein kinase inhibitors and cyclooxygenase inhibitors for use in combination therapy for the treatment of cancer SUGEN, INC (US) 2008-01-22 US disclosed
US-20050176802-A1 Pyrrole substituted 2-indolinone protein kinase inhibitors SUGEN, INC. & PHARMACIA & UPJOHN CO. 2005-08-11 US disclosed
EP-1427326-A4 COMBINATION THERAPY FOR THE TREATMENT OF CANCER SUGEN INC (US) 2005-06-08 EP disclosed
EP-1427326-A2 COMBINATION THERAPY FOR THE TREATMENT OF CANCER Sugen, Inc. (US) 2004-06-16 EP disclosed
US-20040063773-A1 Pyrrole substituted 2-indolinone protein kinase inhibitors SUGEN, INC. & PHARMACIA & UPJOHN CO. 2004-04-01 US disclosed
US-20030216410-A1 Combination therapy for the treatment of cancer PHARMACIA CORPORATION 2003-11-20 US disclosed
US-6573293-B2 Pyrrole substituted 2-indolinone protein kinase inhibitors SUGEN, INC. 2003-06-03 US disclosed
WO-2003015608-A2 COMBINATION THERAPY FOR THE TREATMENT OF CANCER SUGEN, INC. (US) 2003-02-27 WO disclosed
EP-1255752-A2 PYRROLE SUBSTITUTED 2-INDOLINONE PROTEIN KINASE INHIBITORS Sugen, Inc. (US) 2002-11-13 EP disclosed
US-20020156292-A1 Pyrrole substituted 2-indolinone protein kinase inhibitors PHARMACIA & UPJOHN COMPANY LLC 2002-10-24 US disclosed
WO-2001060814-A2 PYRROLE SUBSTITUTED 2-INDOLINONE PROTEIN KINASE INHIBITORS SUGEN, INC. (US) 2001-08-23 WO disclosed