SCHEMBL5084477

SCHEMBL5084477

CC(C)=CC(=N)C=C(C)C

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
SCHEMBL19089945 0.79
SCHEMBL5081575 0.75
SCHEMBL23894224 0.69
SCHEMBL21003900 0.69
SCHEMBL20927546 0.69
SCHEMBL18574043 0.67
SCHEMBL18756018 0.65
SCHEMBL21450794 0.65
Potassium Ion SCHEMBL8466076 0.64
Lithium Ion SCHEMBL3177537 0.64

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108417837-A A kind of aqueous polyimide adhesive of Anode of lithium cell material and preparation method 吴艳飞 2018-08-17 CN disclosed
US-7323520-B2 Anti-aging agents for rubber vulcanizates based on organic compounds containing conjugated azadienes LANXESS DEUTSCHLAND GMBH (DE) 2008-01-29 US disclosed
US-20040087722-A1 Anti-aging agents for rubber vulcanizates based on organic compounds containing conjugated azadienes LANXESS DEUTSCHLAND GMBH (DE) 2004-05-06 US disclosed
EP-1415980-A1 Anti-aging agent for rubber vulcanisates Bayer Aktiengesellschaft (DE) 2004-05-06 EP disclosed