SCHEMBL28449274

SCHEMBL28449274

CCCC1=C([Zr](OC)(OC)OC)CC=C1

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
SCHEMBL21247784 0.89
SCHEMBL16667144 0.87
SCHEMBL21248066 0.83
SCHEMBL21248015 0.80
SCHEMBL5478276 0.80
SCHEMBL7175220 0.80
SCHEMBL6856934 0.78
SCHEMBL21247851 0.76
SCHEMBL21247870 0.76
SCHEMBL21248502 0.76

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111683953-A Group iv metal element-containing compound, method for producing same, precursor composition for film formation containing same, and method for film formation using same UP化学株式会社 2020-09-18 CN disclosed