SCHEMBL2480306

SCHEMBL2480306

CC1CC(=O)c2cccc(Br)c21

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 3/20 0.41
PIM1 P11309 1/20 0.38
CSNK1A1 P48729 1/20 0.38
CDK5 Q00535 1/20 0.38
ROCK1 Q13464 1/20 0.38
DYRK1A Q13627 1/20 0.38
LRRK2 Q5S007 1/20 0.38
CLK4 Q9HAZ1 1/20 0.38
DYRK1B Q9Y463 1/20 0.38
PBRM1 Q86U86 1/20 0.37
S100A4 P26447 1/20 0.36
PARP10 Q53GL7 1/20 0.36
PARP11 Q9NR21 1/20 0.36
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
CA7 P43166 1/20 0.34
CA9 Q16790 1/20 0.34
MAP1LC3B Q9GZQ8 1/20 0.34
LDHA P00338 2/20 0.34
LDHB P07195 2/20 0.34

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
SCHEMBL12205326 0.79 ACHE (0.36) ACHEPIM1CSNK1A1CDK5ROCK1
SCHEMBL8734160 0.77 ACHE (0.38) ACHEPBRM1S100A4CSNK2A2CSNK2A1
SCHEMBL8903475 0.75 ACHE (0.40) ACHES100A4CA1CA2LDHA
SCHEMBL31383949 0.75 PIM1 (0.34) ACHEPIM1CSNK1A1CDK5ROCK1
SCHEMBL30356308 0.75 KIF11 (0.39) PIM1CSNK1A1CDK5ROCK1DYRK1A
SCHEMBL1699423 0.74 PIM1 (0.43) ACHEPIM1CSNK1A1CDK5ROCK1
SCHEMBL30338328 0.74 KIF11 (0.36) KIF11
SCHEMBL7928973 0.73 CYP1A2 (0.38) ACHELDHALDHBTSHRBRD4
SCHEMBL8904346 0.73 PARP1 (0.36) ACHES100A4CSNK2A2CSNK2A1STAT3
SCHEMBL1453605 0.72 ACHE (0.66) ACHEPIM1CSNK1A1CDK5ROCK1

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 29 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3590929-B1 SPIRO COMPOUND AND USE THEREOF MEDSHINE DISCOVERY INC (CN) 2021-09-15 EP disclosed
EP-1963347-B1 HALOGEN SUBSTITUTED METALLOCENE COMPOUNDS FOR OLEFIN POLYMERIZATION EXXONMOBIL CHEM PATENTS INC (US) 2011-10-19 EP disclosed
US-7550544-B2 Halogen substituted metallocene compounds for olefin polymerization EXXONMOBIL CHEMICAL PATENTS INC. (US) 2009-06-23 US disclosed
US-7550544-B2 Halogen substituted metallocene compounds for olefin polymerization EXXONMOBIL CHEMICAL PATENTS INC. (US) 2009-06-23 US disclosed
US-7550544-B2 Halogen substituted metallocene compounds for olefin polymerization EXXONMOBIL CHEMICAL PATENTS INC. (US) 2009-06-23 US disclosed
US-7446216-B2 Halogen substituted metallocene compounds for olefin polymerization EXXONMOBIL CHEMICAL PATENTS INC. (US) 2008-11-04 US disclosed
US-7446216-B2 Halogen substituted metallocene compounds for olefin polymerization EXXONMOBIL CHEMICAL PATENTS INC. (US) 2008-11-04 US disclosed
US-7446216-B2 Halogen substituted metallocene compounds for olefin polymerization EXXONMOBIL CHEMICAL PATENTS INC. (US) 2008-11-04 US disclosed
EP-1963347-A1 HALOGEN SUBSTITUTED METALLOCENE COMPOUNDS FOR OLEFIN POLYMERIZATION ExxonMobil Chemical Patents, Inc., A Corporation of the State of Delaware (US) 2008-09-03 EP disclosed
EP-1833858-A2 HALOGEN SUBSTITUTED METALLOCENE COMPOUNDS FOR OLEFIN POLYMERIZATION Exxonmobil Chemical Patents Inc. (US) 2007-09-19 EP disclosed
EP-0693502-B1 Catalyst component for the polymerization of alpha-olefins and a process for preparing alpha-olefin polymers with use of same MITSUBISHI CHEM CORP (JP) 1997-11-05 EP disclosed
US-5639911-A Hydrazones CIBA-GEIGY CORPORATION (US) 1997-06-17 US disclosed
US-5594081-A METALLOCENES MITSUBISHI CHEMICAL CORPORATION (JP) 1997-01-14 US disclosed
EP-0728773-A1 Catalysts for olefin polymerization and a process for preparing olefin polymers therewith MITSUBISHI CHEMICAL CORPORATION (JP) 1996-08-28 EP disclosed
EP-0693502-A1 Catalyst component for the polymerization of alpha-olefins and a process for preparing alpha-olefin polymers with use of same MITSUBISHI CHEMICAL CORPORATION (JP) 1996-01-24 EP disclosed
US-5461076-A Inhibitors of S-adenosylmethionine decarboxylase; antitumor agents NOVARTIS CORPORATION 1995-10-24 US disclosed
EP-0456133-B1 Hydrazones CIBA GEIGY AG (CH) 1995-03-15 EP disclosed
US-5395855-A Antitumor agents CIBA-GEIGY CORPORATION (US) 1995-03-07 US disclosed
EP-0538193-A2 Condensed cycloaliphatir-amidino-hydrazon salts as S-adenosylmethionin decarboxylase inhibitors CIBA-GEIGY AG (CH) 1993-04-21 EP disclosed
EP-0456133-A1 Hydrazones CIBA-GEIGY AG (CH) 1991-11-13 EP disclosed