SCHEMBL2236111

SCHEMBL2236111

CCC1=CC(C)([Zr]C2(C)C=CC(CC)=C2)C=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
SCHEMBL2234751 0.83
SCHEMBL16223757 0.79 LIPG (0.31)
SCHEMBL16223875 0.71
Hydrochloric Acid SCHEMBL2236742 0.71
Hydrochloric Acid SCHEMBL7948468 0.70
SCHEMBL22188874 0.68
Hydrochloric Acid SCHEMBL14830738 0.68
Hydrochloric Acid SCHEMBL7546624 0.68
Hydrochloric Acid SCHEMBL2357000 0.67
SCHEMBL12641889 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1910432-B1 PROCESS TO PRODUCE LOW VISCOSITY POLY-ALPHA-OLEFINS EXXONMOBIL CHEM PATENTS INC (US) 2014-11-12 EP claimed
EP-1799726-B1 TRIALKYLALUMINUM TREATED SUPPORTS EXXONMOBIL CHEM PATENTS INC (US) 2011-07-13 EP claimed