SCHEMBL1157718

SCHEMBL1157718

CC(C)CC(C)(C#N)N=NC(C)(C#N)CC(C)C.CCC(C)(C#N)N=NC(C)(C#N)CC

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
SCHEMBL7787434 1.00
SCHEMBL7787431 1.00
SCHEMBL14119693 1.00
SCHEMBL8776602 0.93
SCHEMBL27970435 0.91
SCHEMBL14897 0.91
SCHEMBL14898 0.91
SCHEMBL26739247 0.91
Hydrochloric Acid SCHEMBL9811924 0.89
Hydrochloric Acid SCHEMBL9811927 0.89

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0809645-A1 HYDROSILYLATION OF UNSATURATED COMPOUNDS E.I. DU PONT DE NEMOURS AND COMPANY (US) 1997-12-03 EP claimed
WO-1996025418-A1 HYDROSILYLATION OF UNSATURATED COMPOUNDS E.I. DU PONT DE NEMOURS AND COMPANY (US) 1996-08-22 WO claimed
WO-2023013532-A1 PRESSURE-SENSITIVE ADHESIVE TAPE 積水化学工業株式会社 2023-02-09 WO disclosed
US-8681418-B2 Light control film HITACHI CHEMICAL COMPANY, LTD. (JP) 2014-03-25 US disclosed
US-20120307348-A1 LIGHT CONTROL FILM HITACHI CHEMICAL COMPANY, LTD. (JP) 2012-12-06 US disclosed
WO-2011013844-A2 PRODUCTION METHOD OF ALLYL ALCOHOL COPOLYMER SHOWA DENKO K.K. (JP) 2011-02-03 WO disclosed
EP-1449651-B1 Polymerizable composition and lithographic printing plate precursor FUJIFILM CORP (JP) 2008-10-29 EP disclosed
EP-0894802-B1 Silane compound NIPPON MITSUBISHI OIL CORP (JP) 2002-11-06 EP disclosed
US-6150549-A Silane compound NIPPON MITSUBISHI OIL CORPORATION (JP) 2000-11-21 US disclosed
EP-0894802-A2 Silane compound NIPPON OIL CO. LTD. (JP) 1999-02-03 EP disclosed
US-5391620-A Composition suitable as a rheology-influencing agent, a method for its preparation and its use in coating media HERBERTS GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1995-02-21 US disclosed
EP-0473053-A1 Method for the production of fluorine-containing tertiary alcohols HOECHST AKTIENGESELLSCHAFT (DE) 1992-03-04 EP disclosed