SCHEMBL1978765

SCHEMBL1978765

NC1=C[CH]CC=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
SCHEMBL6724092 0.69
SCHEMBL6846074 0.65
SCHEMBL16054526 0.65
SCHEMBL639595 0.65
SCHEMBL3064916 0.65
SCHEMBL2221529 0.65
SCHEMBL10591278 0.64
SCHEMBL6818589 0.62
SCHEMBL3113073 0.62
SCHEMBL3103492 0.62

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3113772-A1 HUMAN PLASMA KALLIKREIN INHIBITORS Biocryst Pharmaceuticals, Inc. (US) 2017-01-11 EP disclosed
EP-2984055-A1 PREPARATION OF SURFACTANTS VIA CROSS-METATHESIS Materia, Inc. (US) 2016-02-17 EP disclosed
WO-2015134998-A1 HUMAN PLASMA KALLIKREIN INHIBITORS BIOCRYST PHARMACEUTICALS, INC. (US) 2015-09-11 WO disclosed
WO-2015126462-A1 PREPARATION OF SURFACTANTS VIA CROSS-METATHESIS MATERIA, INC. (US) 2015-08-27 WO disclosed
US-8987256-B2 Oxo-heterocyclic substituted carboxylic acid derivatives and the use thereof BAYER INTELLECTUAL PROPERTY GMBH (DE) 2015-03-24 US disclosed
WO-2014169080-A1 PREPARATION OF SURFACTANTS VIA CROSS-METATHESIS MATERIA, INC. (US) 2014-10-16 WO disclosed
US-8236795-B2 IL-12 modulatory compounds SYNTA PHARMACEUTICALS CORP. (US) 2012-08-07 US disclosed
US-8158789-B2 Arginine derivatives with NP-I antagonistic activity Ark Therapeutics Group Ltd. (GB) 2012-04-17 US disclosed
US-20110212475-A1 Fluorescently Or Spin-Labeled Kinases For Rapid Screening And Identification Of Novel Kinase Inhibitor Scaffolds MAX-PLANCK GESELLSCHAFT ZUR FORDERUNG DER WISSENSCHAFTEN E.V. (DE) 2011-09-01 US disclosed
EP-2326728-A1 FLUORESCENTLY OR SPIN-LABELED KINASES FOR RAPID SCREENING AND IDENTIFICATION OF NOVEL KINASE INHIBITOR SCAFFOLDS Max-Planck-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) 2011-06-01 EP disclosed
US-20100256132-A1 IL-12 MODULATORY COMPOUNDS SYNTA PHARMACEUTICALS CORPORATION (US) 2010-10-07 US disclosed
US-7696202-B2 IL-12 modulatory compounds SYNTA PHARMACEUTICALS CORP. (US) 2010-04-13 US disclosed
WO-2010009886-A1 FLUORESCENTLY OR SPIN-LABELED KINASES FOR RAPID SCREENING AND IDENTIFICATION OF NOVEL KINASE INHIBITOR SCAFFOLDS MAX-PLANCK-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) 2010-01-28 WO disclosed
US-20100022525-A1 Arginine Derivatives with NP-I Antagonistic Activity GB06/019611.7 THERAPIES LIMITED (GB) 2010-01-28 US disclosed
WO-2008131258-A2 PACTAMYCIN BIOSYNTHETIC GENE CLUSTER STATE OF OREGON ACTING BY AND THROUGH THE STATE BOARD OF HIGHER EDUCATION ON BEHALF OF OREGON STATE UNIVERSITY (US) 2008-10-30 WO disclosed
US-7226949-B2 Compounds of use in the treatment of epilepsy, seizure, and electroconvulsive disorders UNIVERSITY OF KENTUCKY (US) 2007-06-05 US disclosed
US-20060223996-A1 IL-12 modulatory compounds SYNTA PHARMACEUTICALS CORP. (US) 2006-10-05 US disclosed
EP-0162386-A2 Reactive azo dyes BASF Aktiengesellschaft (DE) 1985-11-27 EP disclosed
US-4129661-A 4,5-Dihydro-2-lower alkoxycarbonylamino-4-phenylimidazoles and substituted phenyl derivatives thereof SYNTEX (U.S.A.) INC. (US) 1978-12-12 US disclosed
US-4129661-A 4,5-Dihydro-2-lower alkoxycarbonylamino-4-phenylimidazoles and substituted phenyl derivatives thereof SYNTEX (U.S.A.) INC. (US) 1978-12-12 US disclosed