SCHEMBL3878057

SCHEMBL3878057

[CH2]C(CN)C(=O)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
SCHEMBL131933 0.78
SCHEMBL10703413 0.72
SCHEMBL27292244 0.71
SCHEMBL16994957 0.70
SCHEMBL12499796 0.70
SCHEMBL24804500 0.70
SCHEMBL8778759 0.70
SCHEMBL3039311 0.70
SCHEMBL20776270 0.70
SCHEMBL10067943 0.70

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090274034-A1 OPTICAL RECORDING MEDIUM, VISIBLE INFORMATION RECORDING METHOD AND METHOD FOR USING DYE COMPOUND FUJIFILM CORPORATION (JP) 2009-11-05 US disclosed
EP-2011661-A1 OPTICAL RECORDING MEDIUM, VISIBLE INFORMATION RECORDING METHOD AND USE OF DYE COMPOUND FUJIFILM Corporation (JP) 2009-01-07 EP disclosed