SCHEMBL2861669

SCHEMBL2861669

CC1=CC(=NC#N)C(C)=CC1=NC#N

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
SCHEMBL18634862 1.00
SCHEMBL8894991 0.87
SCHEMBL8896509 0.87
SCHEMBL12019818 0.87
SCHEMBL11910123 0.83
SCHEMBL14129408 0.77
SCHEMBL8895904 0.69
SCHEMBL8896212 0.69 PABPC1 (0.34)
SCHEMBL8894447 0.61
SCHEMBL10854454 0.61

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0582290-B1 Electron density storage device UNIV JOHNS HOPKINS (US) 1997-10-29 EP claimed
EP-0582290-A2 Electron density storage device MITSUBISHI CHEMICAL CORPORATION (JP) 1994-02-09 EP claimed
US-5216661-A ELECTRON DENSITY STORAGE DEVICE USING A STM THE JOHNS HOPKINS UNIVERSITY (US) 1993-06-01 US claimed
US-7749921-B2 Semiconductor element, method for manufacturing the semiconductor element, electronic device and method for manufacturing the electronic device PANASONIC CORPORATION (JP) 2010-07-06 US disclosed
US-20090194763-A1 SEMICONDUCTOR ELEMENT, METHOD FOR MANUFACTURING THE SEMICONDUCTOR ELEMENT, ELECTRONIC DEVICE AND METHOD FOR MANUFACTURING THE ELECTRONIC DEVICE PANASONIC CORPORATION (JP) 2009-08-06 US disclosed
EP-0582290-B1 Electron density storage device UNIV JOHNS HOPKINS (US) 1997-10-29 EP disclosed
EP-0582290-A2 Electron density storage device MITSUBISHI CHEMICAL CORPORATION (JP) 1994-02-09 EP disclosed
US-5216661-A ELECTRON DENSITY STORAGE DEVICE USING A STM THE JOHNS HOPKINS UNIVERSITY (US) 1993-06-01 US disclosed
US-4897289-A DISSOVING OR SWELLING THE SURFACE WITH A SOLVENT AND APPLYING AN ORGANIC ELECTRON ACCEPTOR, ORGANIC ELECTRON DONORS AND/OR IODIDES BASF AKTIENGESELLSCHAFT (DE) 1990-01-30 US disclosed
US-4885368-A SEMICONDUCTORS, PHOTOCONDUCTORS, ELECTRODES, BATTERIES BASF AKTIENGESELLSCHAFT (DE) 1989-12-05 US disclosed