SCHEMBL7039658

SCHEMBL7039658

CC1=Cc2c(-c3cccc4ccccc34)cccc2C1CC1C(C)=Cc2c(-c3cccc4ccccc34)cccc21

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.36
MAPT P10636 2/20 0.36
HPGD P15428 2/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
CYP2A6 P11509 1/20 0.35
CA12 O43570 3/20 0.35
CA1 P00915 3/20 0.35
CA2 P00918 3/20 0.35
CA9 Q16790 3/20 0.35
SLC6A4 P31645 5/20 0.34
DHFR P00374 1/20 0.34
SLC6A2 P23975 2/20 0.33
SLC6A3 Q01959 2/20 0.33
KDM4E B2RXH2 2/20 0.33
PTPN1 P18031 1/20 0.33
TDP2 O95551 1/20 0.33
ALOX12 P18054 1/20 0.33
MAPK1 P28482 1/20 0.33
CASP3 P42574 1/20 0.33

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
SCHEMBL1452836 0.92 CA12 (0.33) ALDH1A1MAPTHPGDMEN1KMT2A
SCHEMBL4622950 0.91 ALDH1A1 (0.36) ALDH1A1MAPTHPGDMEN1KMT2A
SCHEMBL3996671 0.90 SLC6A4 (0.35) ALDH1A1MAPTHPGDMEN1KMT2A
SCHEMBL8678964 0.88 ALDH1A1 (0.34) ALDH1A1MAPTHPGDMEN1KMT2A
SCHEMBL1241803 0.87 ALDH1A1 (0.33) ALDH1A1MAPTHPGDMEN1KMT2A
SCHEMBL7781565 0.87 CYP1A2 (0.40) ALDH1A1MAPTHPGDMEN1KMT2A
SCHEMBL4286443 0.86 ALDH1A1 (0.33) ALDH1A1MAPTHPGDMEN1KMT2A
SCHEMBL7150481 0.85 ALDH1A1 (0.32) ALDH1A1MAPTHPGDMEN1KMT2A
SCHEMBL1454085 0.85 SLC6A2 (0.33) ALDH1A1MAPTHPGDMEN1KMT2A
SCHEMBL7038278 0.84 KDM4E (0.41) ALDH1A1MAPTHPGDMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6620953-B1 Complexing dimethylbis(2-methyl-4,5-benzoindenyl)silane with transition metal compounds such as 2,4-di-tert-butylphenoxide, zirconium monochloride, to form polymerization catalysts BASSELL POLYOLEFINE GMBH (DE) 2003-09-16 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-1133504-B1 METHOD FOR PRODUCING MONOARYLOXY-ANSA-METALLOCENES BASELL POLYOLEFINE GMBH (DE) 2003-03-12 EP disclosed
EP-0832866-B1 Process for the preparation of methylene-bridged biscyclopentadienyl compounds BASELL POLYOLEFINE GMBH (DE) 2002-01-09 EP disclosed
EP-1134227-A2 Methylene-bridged biscyclopentadienyl compounds Basell Polyolefine GmbH (DE) 2001-09-19 EP disclosed
EP-1133504-A1 METHOD FOR PRODUCING MONOARYLOXY-ANSA-METALLOCENES Basell Polypropylen GmbH (DE) 2001-09-19 EP disclosed
US-6255508-B1 COORDINATION CATALYST; ALPHA-OLEFIN POLYMERIZATION CATALYST TARGOR GMBH (DE) 2001-07-03 US disclosed
WO-2000031091-A1 METHOD FOR PRODUCING MONOARYLOXY-ANSA-METALLOCENES BASELL POLYPROPYLEN GMBH (DE) 2000-06-02 WO disclosed
US-5945553-A Process for preparing a methylene-bridged biscyclopentadienyl compound TARGOR GMBH (DE) 1999-08-31 US disclosed
EP-0832866-A2 Process for the preparation of methylene-bridged biscyclopentadienyl compounds TARGOR GmbH (DE) 1998-04-01 EP disclosed