SCHEMBL5837366

SCHEMBL5837366

CC1=Cc2c(-c3ccccc3)cccc2C1[Si](c1ccccc1)(c1ccccc1)C1C(C)=Cc2c(-c3ccccc3)cccc21

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PDCD1 Q15116 1/20 0.33
CD274 Q9NZQ7 1/20 0.33
CHRNB2 P17787 1/20 0.31
CHRNA4 P43681 1/20 0.31
AKT1 P31749 1/20 0.30
AKT2 P31751 1/20 0.30
TGFBR1 P36897 1/20 0.30
BRD4 O60885 1/20 0.30

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
SCHEMBL5837068 0.87 PDCD1 (0.32) PDCD1CD274CHRNB2CHRNA4
SCHEMBL7053136 0.86 PDCD1 (0.35) PDCD1CD274CHRNB2CHRNA4AKT1
SCHEMBL7050759 0.86 PDCD1 (0.35) PDCD1CD274CHRNB2CHRNA4AKT1
SCHEMBL7048706 0.85 PDCD1 (0.31) PDCD1CD274CHRNB2CHRNA4
SCHEMBL61908 0.84 PDCD1 (0.34) PDCD1CD274CHRNB2CHRNA4AKT1
SCHEMBL7048688 0.84 PDCD1 (0.34) PDCD1CD274CHRNB2CHRNA4AKT1
SCHEMBL29366427 0.84 PDCD1 (0.34) PDCD1CD274CHRNB2CHRNA4AKT1
SCHEMBL7053161 0.84 PDCD1 (0.34) PDCD1CD274CHRNB2CHRNA4AKT1
SCHEMBL7054636 0.84 PDCD1 (0.30) PDCD1CD274
SCHEMBL5837098 0.84

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6984743-B1 Method for producing metallocenes BASELL POLYOLEFINE GMBH (DE) 2006-01-10 US disclosed
EP-0985674-B1 ORGANIC COMPOUNDS CONTAINING SILICON OR GERMANIUM, TRANSITION METAL COMPLEXES, CATALYST FOR ALPHA-OLEFIN POLYMERIZATION, AND PROCESSES FOR PRODUCING ALPHA-OLEFIN POLYMERS MITSUBISHI CHEM CORP (JP) 2003-04-23 EP disclosed
EP-1015463-B1 METHOD FOR PRODUCING METALLOCENES BASELL POLYOLEFINE GMBH (DE) 2002-12-11 EP disclosed
US-6255515-B1 COORDINATION POLYMERIZATION CATALYSTS MITSUBISHI CHEMICAL CORPORATION (JP) 2001-07-03 US disclosed
EP-1015463-A1 METHOD FOR PRODUCING METALLOCENES Basell Polyolefine GmbH (DE) 2000-07-05 EP disclosed
EP-0985674-A1 ORGANIC COMPOUNDS CONTAINING SILICON OR GERMANIUM, TRANSITION METAL COMPLEXES, CATALYST FOR $g(a)-OLEFIN POLYMERIZATION, AND PROCESSES FOR PRODUCING $g(a)-OLEFIN POLYMERS MITSUBISHI CHEMICAL CORPORATION (JP) 2000-03-15 EP disclosed
WO-1999012943-A1 METHOD FOR PRODUCING METALLOCENES TARGOR GMBH (DE) 1999-03-18 WO disclosed