SCHEMBL10085447

SCHEMBL10085447

C=C1C=CC(=O)N1C

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
SCHEMBL25436194 0.78 MGLL (1.00)
SCHEMBL36966 0.78
SCHEMBL976025 0.72 MGLL (0.72)
Cyclohexane SCHEMBL10699372 0.71 MGLL (0.81)
Cyclohexane SCHEMBL23390014 0.71 MGLL (0.81)
SCHEMBL12056284 0.69 MGLL (0.50)
SCHEMBL17190596 0.69 MGLL (0.56)
SCHEMBL18976528 0.67 GSK3A (0.55)
SCHEMBL9505057 0.67 GSK3A (0.42)
SCHEMBL12146262 0.67 MGLL (0.36)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2021013693-A1 ANTIBODY DRUG CONJUGATES (ADCS) WITH NAMPT INHIBITORS BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2021-01-28 WO disclosed
WO-2019032961-A1 TRIOXACARCIN-ANTIBODY CONJUGATES AND USES THEREOF PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2019-02-14 WO disclosed
WO-2019028117-A1 CURABLE COMPOSITIONS Henkel IP & Holding GmbH (DE) 2019-02-07 WO disclosed
US-20180212158-A1 ORGANIC LIGHT-EMITTING DIODE MATERIALS PRESIDENT AND FELLOWS OF HARVARD COLLEGE 2018-07-26 US disclosed
US-10005772-B2 Immune response modifier compositions and methods 3M INNOVATIVE PROPERTIES COMPANY (US) 2018-06-26 US disclosed
US-9944730-B2 Polymers derived from norbornadiene and maleic anhydride and use thereof PROMERUS, LLC (US) 2018-04-17 US disclosed
US-9919995-B2 Photoactivatable caged compounds with AIE characteristics: method of preparation and applications Tang, Benzhong (CN) 2018-03-20 US disclosed
US-20180044449-A1 POLYMERS DERIVED FROM NORBORNADIENE AND MALEIC ANHYDRIDE AND USE THEREOF PROMERUS, LLC (US) 2018-02-15 US disclosed
US-9834627-B2 Polymers derived from norbornadiene and maleic anhydride and use thereof PROMERUS, LLC (US) 2017-12-05 US disclosed
US-9834808-B2 Methods for rapid antibiotic susceptibility testing SeLux Diagnostics, Inc. (US) 2017-12-05 US disclosed
EP-1556360-B1 ELECTROLUMINESCENT DEVICE CIBA SC HOLDING AG (CH) 2008-01-23 EP disclosed
WO-2008006743-A1 NOVEL ELECTROLUMINESCENT POLYMERS FOR ELECTRONIC APPLICATIONS CIBA HOLDING INC (CH) 2008-01-17 WO disclosed
US-20070295454-A1 Reworkable compositions and methods for use thereof EDWARDS MAURY 2007-12-27 US disclosed
EP-1438041-B1 SPERMICIDES LRC PRODUCTS (GB) 2007-11-28 EP disclosed
US-7285613-B2 Free-radical curable polyesters and methods for use thereof DESIGNER MOLECULES, INC. (US) 2007-10-23 US disclosed
US-20070205399-A1 Adhesive compositions containing cyclic siloxanes and methods for use thereof DESIGNER MOLECULES, INC. 2007-09-06 US disclosed
WO-2007075534-A2 POLYMER CONJUGATES OF GLP-1 NEKTAR THERAPEUTICS AL, CORPORATION (US) 2007-07-05 WO disclosed
US-20070134197-A1 Conjugates of hydroxyalkyl starch and a protein, prepared by reductive amination FRESENIUS KABI DEUTSCHLAND GMBH (DE) 2007-06-14 US disclosed
WO-2007036589-A1 MICROPOROUS CRYSTALLINE ZEOLITE MATERIAL, ZEOLITE ITQ-32, PREPARATION METHOD THEREOF AND USE OF SAME CONSEJO SUPERIOR DE INVESTIGACIONES CIENTÍFICAS (ES) 2007-04-05 WO disclosed
US-20070014725-A1 Conjugates of macrocyclic metal complexes with biomolecules and their use for the production of agents for NMR diagnosis and radiodiagnosis as well as radiotherapy SCHERING AG (DE) 2007-01-18 US disclosed