SCHEMBL544772

SCHEMBL544772

C1CN2CNC1C2

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
SCHEMBL4861649 0.84
SCHEMBL13835607 0.82
Hydrochloric Acid SCHEMBL15192075 0.80
SCHEMBL14699785 0.76
SCHEMBL767920 0.76
SCHEMBL5422549 0.76
SCHEMBL6484885 0.76
SCHEMBL13836325 0.76
Hydrochloric Acid SCHEMBL767923 0.74 CHRNA7 (0.32)
Hydrochloric Acid SCHEMBL5428520 0.74 CHRNA7 (0.32)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130081999-A1 Bridged Macrocyclic Module Compositions WHITEFORD JEFFERY A (US) 2013-04-04 US claimed
US-20100152438-A1 AMPHIPHILIC MOLECULAR MODULES AND CONSTRUCTS BASED THEREON COVALENT PARTNERS LLC 2010-06-17 US claimed
US-20080290034-A1 Bridged macrocyclic module compositions COVALENT PARTNERS LLC 2008-11-27 US claimed
US-20060270846-A1 Amphiphilic molecular modules and constructs based thereon COVALENT PARTNERS, LLC (US) 2006-11-30 US claimed
US-20060128680-A1 Macrocyclic module compositions KRIESEL JOSH 2006-06-15 US claimed
US-20050154199-A1 Bridged macrocyclic module compositions COVALENT PARTNERS LLC 2005-07-14 US claimed
EP-1480635-A4 MACROCYCLIC MODULE COMPOSITIONS COVALENT PARTNERS LLC (US) 2005-06-29 EP claimed
EP-1480635-A2 MACROCYCLIC MODULE COMPOSITIONS Covalent Partners, LLC (US) 2004-12-01 EP claimed
US-20040034223-A1 Amphiphilic molecular modules and constructs based thereon COVALENT PARTNERS, LLC. 2004-02-19 US claimed
US-20030199688-A1 Macrocyclic module compositions COVALENT PARTNERS, LLC 2003-10-23 US claimed
WO-2003066646-A2 MACROCYCLIC MODULE COMPOSITIONS COVALENT PARTNERS, LLC (US) 2003-08-14 WO claimed
WO-2023118195-A1 FAP-TARGETING PHARMACEUTICAL PRODUCT FOR THERAPY AND DIAGNOSIS OF CANCERS Atoms for Cure GmbH (DE) 2023-06-29 WO disclosed
WO-2022258637-A1 TRISLINKER-CONJUGATED DIMERIC LABELLING PRECURSORS AND RADIOTRACERS DERIVED THEREFROM Atoms for Cure GmbH (DE) 2022-12-15 WO disclosed
EP-3281933-B1 (METH)ACRYLATE MANUFACTURING METHOD TOAGOSEI CO LTD (JP) 2020-08-19 EP disclosed
US-10619058-B2 Curable composition TOAGOSEI CO., LTD. (JP) 2020-04-14 US disclosed
US-5091383-A SUBSTITUTED BRIDGED DIAZABICYCLOALKYL QUINOLONE CARBOXYLIC ACIDS PFIZER INC. (US) 1992-02-25 US disclosed
EP-0215650-B1 SUBSTITUTED BRIDGED-DIAZABICYCLOALKYL QUINOLONE CARBOXYLIC ACIDS PFIZER INC. (US) 1992-01-29 EP disclosed
US-4861779-A Anti-bacterial substituted bridged-diazabicycloalkyl quinolone carboxylic acids PFIZER INC. (US) 1989-08-29 US disclosed
US-4775668-A Substituted bridged-diazabicycloalkyl quinolone carboxylic acids and anti-bacterial use thereof PFIZER INC. (US) 1988-10-04 US disclosed
EP-0215650-A2 Substituted bridged-diazabicycloalkyl quinolone carboxylic acids PFIZER INC. (US) 1987-03-25 EP disclosed