SCHEMBL5872670

SCHEMBL5872670

C=[Zr](Cl)(Cl)(C1C=Cc2c(-c3ccccc3)cccc21)C1C=Cc2c(-c3ccccc3)cccc21

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CYP2A6 P11509 1/20 0.32
CHRNB2 P17787 1/20 0.32
CHRNA4 P43681 1/20 0.32

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

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
SCHEMBL5872681 0.81 CHRNB2 (0.30) CYP2A6CHRNB2CHRNA4
SCHEMBL627681 0.81 CHRNB2 (0.30) CYP2A6CHRNB2CHRNA4
SCHEMBL8856002 0.81 CHRNB2 (0.33) CYP2A6CHRNB2CHRNA4
SCHEMBL665513 0.81 CHRNB2 (0.30) CYP2A6CHRNB2CHRNA4
SCHEMBL8855996 0.80 TDP1 (0.30)
SCHEMBL7203993 0.78 CHRNB2 (0.32) CHRNB2CHRNA4
Hydrochloric Acid SCHEMBL665514 0.77 CHRNB2 (0.31) CHRNB2CHRNA4
SCHEMBL7641883 0.76
SCHEMBL2861822 0.76
SCHEMBL20604201 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 12 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6255508-B1 COORDINATION CATALYST; ALPHA-OLEFIN POLYMERIZATION CATALYST TARGOR GMBH (DE) 2001-07-03 US claimed
US-5945553-A Process for preparing a methylene-bridged biscyclopentadienyl compound TARGOR GMBH (DE) 1999-08-31 US claimed
US-7105608-B2 Copolymer of propylene with a conjugated diene and a process of preparing the same TONEN CHEMICAL CORPORATION (JP) 2006-09-12 US disclosed
US-20050154139-A1 Copolymer of propylene with a conjugated diene and a process of preparing the same TONEN CHEMICAL CORPORATION (JP) 2005-07-14 US disclosed
EP-0914323-B1 METALLOCENES AND CATALYSTS FOR POLYMERIZATION OF OLEFINS BASELL POLYOLEFINE GMBH (DE) 2003-08-06 EP disclosed
US-6268518-B1 AS POLYMERIZATION CATALYSTS FOR POLYMERIZATION OF OLEFINS MONTELL TECHNOLOGY COMPANY B.V. (NL) 2001-07-31 US disclosed
US-6255508-B1 COORDINATION CATALYST; ALPHA-OLEFIN POLYMERIZATION CATALYST TARGOR GMBH (DE) 2001-07-03 US disclosed
US-5945553-A Process for preparing a methylene-bridged biscyclopentadienyl compound TARGOR GMBH (DE) 1999-08-31 US disclosed
EP-0914323-A1 METALLOCENES AND CATALYSTS FOR POLYMERIZATION OF OLEFINS Montell Technology Company B.V. (NL) 1999-05-12 EP disclosed
WO-1998043989-A1 METALLOCENES AND CATALYSTS FOR POLYMERIZATION OF OLEFINS MONTELL TECHNOLOGY COMPANY B.V. (NL) 1998-10-08 WO disclosed
US-5698645-A POLYMERIZING AT LEAST ONE CYCLOOLEFIN AND ONE ACYCLIC OLEFIN IN THE PRESENCE OF A METALLOCENE CATALYST AND A COCATALYST HOECHST AKTIENGESELLSCHAFT (DE) 1997-12-16 US disclosed
US-5670681-A Process for preparing a carbon-bridged biscyclopentadiene compound HOECHST AKTIENGESELLSCHAFT (DE) 1997-09-23 US disclosed