SCHEMBL4551310

SCHEMBL4551310

C1=CCC([Cr]C2=CC=CC2)=C1.CC1=C(C)C(C)C([Ti](NC(C)(C)C)[SiH](C)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
SCHEMBL251872 0.82
Hydrochloric Acid SCHEMBL2049176 0.80
Hydrochloric Acid SCHEMBL28815623 0.64
SCHEMBL50467 0.62
SCHEMBL822343 0.61
Hydrochloric Acid SCHEMBL4787357 0.60
Hydrochloric Acid SCHEMBL19512568 0.60
SCHEMBL6064018 0.60
SCHEMBL5664444 0.60
SCHEMBL5663736 0.60

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-8455601-B2 Polyolefin film UNIVATION TECHNOLOGIES, LLC (US) 2013-06-04 US disclosed
US-20090306323-A1 POLYOLEFIN FILM UNIVATION TECHNOLOGIES, LLC 2009-12-10 US disclosed