SCHEMBL9472199

SCHEMBL9472199

N#CC(C#N)N1C=NCC1

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
SCHEMBL906547 0.69
Hydrochloric Acid SCHEMBL6820706 0.67
Hydrochloric Acid SCHEMBL16540232 0.67
SCHEMBL4760503 0.64
SCHEMBL12494680 0.59
SCHEMBL28060956 0.58
SCHEMBL21180932 0.57
Water SCHEMBL8209107 0.57
SCHEMBL10479106 0.57
Water SCHEMBL27800312 0.57

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 31 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
EP-2751065-B1 METHOD FOR PRODUCING EDDN AND/OR EDMN THROUGH THE CONVERSION OF EDFA AND/OR EDMFA WITH HCN BASF SE (DE) 2016-11-16 EP disclosed
US-9096497-B2 Process for preparing EDDN and EDMN BASF SE (DE) 2015-08-04 US disclosed
US-9012638-B2 Process for preparing EDDN and/or EDMN by conversion of FACH and EDA BASF SE (DE) 2015-04-21 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
EP-2751067-A1 METHOD FOR PROCESSING REACTION PRODUCT STEMMING FROM THE HYDROGENATION OF EDDN OR EDMN BASF SE (DE) 2014-07-09 EP disclosed
EP-2751066-A1 METHOD FOR PRODUCING EDFA AND/OR EDMFA AND DETA AND/OR TETA BASF SE (DE) 2014-07-09 EP disclosed
EP-2751069-A1 METHOD FOR PRODUCING EDDN AND/OR EDMN BASF SE (DE) 2014-07-09 EP disclosed
EP-2751068-A1 METHOD FOR PRODUCING EDDN AND/OR EDMN BY CONVERTING FACH AND EDA BASF SE (DE) 2014-07-09 EP disclosed
WO-2013030254-A1 METHOD FOR THE PRODUCTION OF TETA AND/OR DETA BASF SE (DE) 2013-03-07 WO 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-20130053536-A1 PROCESS FOR PREPARING EDDN AND/OR EDMN AND A PROCESS FOR PREPARING DETA AND/OR TETA BASF SE (DE) 2013-02-28 US disclosed
US-20130053538-A1 PROCESS FOR PREPARING EDFA AND/OR EDMFA AND DETA AND/OR TETA BASF SE (DE) 2013-02-28 US disclosed
US-20130053584-A1 PROCESS FOR PREPARING EDDN AND/OR EDMN BY REACTING EDFA AND/OR EDMFA WITH HCN BASF SE (DE) 2013-02-28 US disclosed
US-20130053539-A1 PROCESS FOR PREPARING EDDN AND/OR EDMN AND PROCESS FOR PREPARING DETA AND/OR TETA BASF SE (DE) 2013-02-28 US disclosed
EP-0527181-A4 HETEROCYCLICETHENEDIYL COMPOUNDS WHICH INHIBIT EGF RECEPTOR TYROSINE KINASE 1993-04-07 EP disclosed
US-5196446-A Treatment of psoriasis, atherosclerosis YISSUM RESEARCH DEVELOPMENT COMPANY OF THE HEBREW UNIVERSITY OF JERUSALEM (IL) 1993-03-23 US disclosed
EP-0527181-A1 HETEROCYCLICETHENEDIYL COMPOUNDS WHICH INHIBIT EGF RECEPTOR TYROSINE KINASE YISSUM RESEARCH DEVELOPMENT COMPANY OF THE HEBREW UNIVERSITY OF JERUSALEM (IL) 1993-02-17 EP disclosed
WO-1991016305-A1 HETEROCYCLICETHENEDIYL COMPOUNDS WHICH INHIBIT EGF RECEPTOR TYROSINE KINASE RHONE-POULENC RORER INTERNATIONAL (HOLDINGS), INC. (US) 1991-10-31 WO disclosed