SCHEMBL8728384

SCHEMBL8728384

CC1=NC(C)=C(C)N(C)C1C

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
SCHEMBL16458677 0.73
SCHEMBL14907287 0.70
SCHEMBL15082808 0.62
SCHEMBL10506619 0.60
SCHEMBL11133011 0.60
SCHEMBL5986747 0.60
SCHEMBL2454337 0.58
SCHEMBL487087 0.56 KDM4E (0.35)
SCHEMBL11133015 0.55
SCHEMBL14907173 0.55

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5587776-A Member comprising a polyurethane rubber composition containing an amino catalyst for regulating quantity of developer and developing unit using the same CANON KABUSHIKI KAISHA (JP) 1996-12-24 US claimed
EP-0659788-A1 Member for regulating quantity of developer and developing unit using the same CANON KABUSHIKI KAISHA (JP) 1995-06-28 EP claimed
WO-2023141455-A3 E TO 1.5 PENTANEDIAMINE AND SEPARATION OF DIAMINES FROM AMINO AND CARBOXYLIC ACIDS ARCHER DANIELS MIDLAND COMPANY (US) 2023-10-26 WO disclosed
WO-2023141455-A2 E TO 1.5 PENTANEDIAMINE AND SEPARATION OF DIAMINES FROM AMINO AND CARBOXYLIC ACIDS ARCHER DANIELS MIDLAND COMPANY (US) 2023-07-27 WO disclosed
CN-102618587-B Method for producing acetoin by vinasse fermentation and producing tetramethylpyrazine by acetoin transformation UNIV JIANGNAN 2014-02-19 CN disclosed
US-5719239-A THERMOSETTING RESIN GEORGIA-PACIFIC RESINS, INC. (US) 1998-02-17 US disclosed
US-5391340-A Method of manufacture of top coated cellulosic panel GEORGIA-PACIFIC RESINS, INC. (US) 1995-02-21 US disclosed