SCHEMBL5362668

SCHEMBL5362668

Cc1ccccc1N=CCc1cccc(CC=Nc2ccccc2C)n1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 1/20 0.47
MAPT P10636 5/20 0.41
ALDH1A1 P00352 3/20 0.41
KDM4E B2RXH2 2/20 0.41
RECQL P46063 2/20 0.41
POLB P06746 2/20 0.41
MPI P34949 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
LMNA P02545 4/20 0.37
HPGD P15428 1/20 0.37
NPC1 O15118 2/20 0.35
RAB9A P51151 2/20 0.35
PKM P14618 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
KCNH2 Q12809 3/20 0.32
HTT P42858 2/20 0.32
GLA P06280 1/20 0.32
GAA P10253 1/20 0.32
THRB P10828 1/20 0.32
TDP1 Q9NUW8 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
Hydrochloric Acid SCHEMBL7095603 0.97 CYP2C9 (0.45) CYP2C9MAPTALDH1A1KDM4ERECQL
SCHEMBL16835711 0.83 CYP2C9 (0.45) CYP2C9MAPTALDH1A1KDM4ERECQL
SCHEMBL7053846 0.82 POLB (0.33) POLBKCNH2HRH4NPSR1NOS1
SCHEMBL5349583 0.82 DHODH (0.44) CYP2C9MAPTALDH1A1KDM4EPOLB
Hydrochloric Acid SCHEMBL4620930 0.81 MAPT (0.31) CYP2C9MAPTKDM4ELMNAGAA
SCHEMBL6062806 0.80 CYP3A4 (0.38) CYP2C9ALDH1A1KCNH2GAAHRH4
SCHEMBL4618650 0.80 ALDH1A1 (0.37) CYP2C9ALDH1A1KDM4EPOLBHPGD
Hydrochloric Acid SCHEMBL6142148 0.79 CYP2C9 (0.39) CYP2C9MAPTALDH1A1KDM4ERECQL
Hydrochloric Acid SCHEMBL16654018 0.79 POLB (0.31) KDM4EPOLBKCNH2TDP1HRH4
SCHEMBL21239558 0.79 L3MBTL1 (0.43) CYP2C9MAPTALDH1A1KDM4ERECQL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2841471-A1 ACTIVATOR COMPOSITIONS, THEIR PREPARATION, AND THEIR USE IN CATALYSTS Albemarle Corporation (US) 2015-03-04 EP disclosed
WO-2013162745-A1 ACTIVATOR COMPOSITIONS, THEIR PREPARATION, AND THEIR USE IN CATALYSTS ALBEMARLE CORPORATION (US) 2013-10-31 WO disclosed
EP-2643366-A2 ACTIVATOR COMPOSITIONS, THEIR PREPARATION, AND THEIR USE IN CATALYSIS Albemarle Corporation (US) 2013-10-02 EP disclosed
WO-2012071205-A2 ACTIVATOR COMPOSITIONS, THEIR PREPARATION, AND THEIR USE IN CATALYSIS ALBEMARLE CORPORATION (US) 2012-05-31 WO disclosed
US-7238764-B2 Process for the co-oligomerisation of ethylene and alpha olefins SHELL OIL COMPANY (US) 2007-07-03 US disclosed
EP-1701963-A1 HALOALUMINOXANE COMPOSITIONS, THEIR PREPARATION, AND THEIR USE IN CATALYSIS ALBEMARLE CORPORATION (US) 2006-09-20 EP disclosed
EP-1556317-A1 SELECTIVE ISOMERIZATION AND LINEAR DIMERIZATION OF ALPHA-OLEFINS USING COBALT CATALYSTS Chevron Phillips Chemical Company LP (US) 2005-07-27 EP disclosed
WO-2005066191-A1 HALOALUMINOXANE COMPOSITIONS, THEIR PREPARATION, AND THEIR USE IN CATALYSIS ALBEMARLE CORPORATION (US) 2005-07-21 WO disclosed
EP-1521758-A1 LATE TRANSITION METAL CATALYSTS FOR OLEFIN POLYMERIZATION AND OLIGOMERIZATION Exxonmobil Chemical Patents Inc. (US) 2005-04-13 EP disclosed
US-20050059786-A1 Process for the co-oligomerisation of ethylene and alpha olefins DE BOER ERIC JOHANNES MARIA (NL) 2005-03-17 US disclosed
EP-1492746-A1 SELECTIVE COUPLING OF TERMINAL OLEFINS WITH ETHYLENE TO MANUFACTURE LINEAR ALPHA-OLEFINS ExxonMobil Research and Engineering Company (US) 2005-01-05 EP disclosed
WO-2004033398-A1 SELECTIVE ISOMERIZATION AND LINEAR DIMERIZATION OF ALPHA-OLEFINS USING COBALT CATALYSTS CHEVRON PHILLIPS CHEMICAL COMPANY, LP (US) 2004-04-22 WO disclosed
WO-2004007509-A1 LATE TRANSITION METAL CATALYSTS FOR OLEFIN POLYMERIZATION AND OLIGOMERIZATION EXXONMOBIL CHEMICAL PATENTS INC. (US) 2004-01-22 WO disclosed
WO-2003082466-A1 HYDROCARBYLHALOALUMINO XANES ALBEMARLE CORPORATION (US) 2003-10-09 WO disclosed
EP-1341796-A1 ENHANCED POLYMERIZATION REACTIONS BASED ON USE OF SPECIAL METHYLALUMINOXANE COMPOSITIONS ALBEMARLE CORPORATION (US) 2003-09-10 EP disclosed
WO-2003072529-A1 SELECTIVE COUPLING OF TERMINAL OLEFINS WITH ETHYLENE TO MANUFACTURE LINEAR ALPHA-OLEFINS EXXONMOBIL RESEARCH AND ENGINEERING COMPANY (US) 2003-09-04 WO disclosed
WO-2002060908-A1 ENHANCED POLYMERIZATION REACTIONS BASED ON USE OF SPECIAL METHYLALUMINOXANE COMPOSITIONS ALBEMARLE CORPORATION (US) 2002-08-08 WO disclosed