SCHEMBL3686734

SCHEMBL3686734

CC1=C(C)C(C)(C)C([Ti](Cl)(Cl)Oc2c(-c3ccccc3C(C)C)cc(C)cc2-c2ccccc2C(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
SCHEMBL3683551 0.86 NPC1 (0.31)
SCHEMBL3681805 0.82 NUDT1 (0.32)
SCHEMBL618897 0.81
SCHEMBL3806063 0.77 BACE1 (0.34)
SCHEMBL3624517 0.77 KDM4E (0.32)
SCHEMBL3843229 0.76 PTPN5 (0.35)
SCHEMBL3685655 0.69 CDC25A (0.40)
SCHEMBL3676430 0.69 L3MBTL1 (0.35)
SCHEMBL3267492 0.67 NLRP3 (0.30)
Hydrochloric Acid SCHEMBL3613368 0.67 NPC1 (0.31)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7833926-B2 Arylphenoxy catalyst system for producing ethylene homopolymer or copolymers of ethylene and α-olefins SK ENERGY CO., LTD. (KR) 2010-11-16 US disclosed
US-20090326175-A1 ARYLPHENOXY CATALYST SYSTEM FOR PRODUCING ETHYLENE HOMOPOLYMER OR COPOLYMERS OF ETHYLENE AND a-OLEFINS SK ENERGY CO., LTD. (KR) 2009-12-31 US disclosed
US-7589042-B2 Arylphenoxy catalyst system for producing ethylene homopolymer or copolymers of ethylene and α-olefins SK CORPORATION (KR) 2009-09-15 US disclosed
US-20070135297-A1 ARYLPHENOXY CATALYST SYSTEM FOR PRODUCING ETHYLENE HOMOPOLYMER OR COPOLYMERS OF ETHYLENE AND a-OLEFINS SK CORPORATION (KR) 2007-06-14 US disclosed
US-20070004586-A1 Arylphenoxy catalyst system for producing ethylene homopolymer or copolymers of ethylene and alpha-olefins SK CORPORATION (KR) 2007-01-04 US disclosed