SCHEMBL3825529

SCHEMBL3825529

Cc1cc(O[Ti](C2=C(C(C)(C)C)C=CC2)=C(c2ccccc2)c2ccccc2)cc([Si](C)(C)C(C)(C)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
Hydrochloric Acid SCHEMBL819234 0.99
Hydrochloric Acid SCHEMBL820097 0.91
SCHEMBL7932614 0.90
Hydrochloric Acid SCHEMBL820533 0.89
SCHEMBL3827612 0.88
Hydrochloric Acid SCHEMBL713882 0.88
SCHEMBL4088204 0.87
Hydrochloric Acid SCHEMBL713614 0.87
Hydrochloric Acid SCHEMBL820171 0.86
Hydrochloric Acid SCHEMBL716698 0.83 TACR1 (0.32)

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-1113025-B1 Catalyst for addition polymerization, and process for producing addition polymer SUMITOMO CHEMICAL CO (JP) 2009-09-02 EP disclosed
US-6187889-B1 COPOLYMER OF AN ALPHA-OLEFIN WITH AN ALKENYL AROMATIC HYDROCARBON, HAVING A STRUCTURE AT WHICH TERTIARY CARBON ATOMS ARE MUTUALLY SEPARATED BY TWO METHYLENE GROUPS IN THE BACKBONE OF THE COPOLYMER; STRETCHING, WRAPPING FILMS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2001-02-13 US disclosed