SCHEMBL813713

SCHEMBL813713

Cc1cc(C)cc(/N=C/c2nc3c(-c4ccccc4)ccc(-c4ccccc4)c3n2C)c1

nearest known ligand 0.34

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.34
KDM4E B2RXH2 3/20 0.34
ALDH1A1 P00352 2/20 0.34
LMNA P02545 2/20 0.34
MEN1 O00255 1/20 0.34
POLB P06746 1/20 0.34
HSP90AA1 P07900 1/20 0.34
KMT2A Q03164 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
GAA P10253 2/20 0.33
PSMB5 P28074 2/20 0.33
MET P08581 1/20 0.32
TP53 P04637 2/20 0.30
ALOX15 P16050 1/20 0.30
TSHR P16473 1/20 0.30
HSD11B1 P28845 1/20 0.30
NUDT1 P36639 1/20 0.30
RAB9A P51151 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
SCHEMBL814526 0.89 MAPT (0.36) MAPTKDM4EALDH1A1LMNAMEN1
SCHEMBL814091 0.87 PSMB5 (0.36) MAPTKDM4EALDH1A1POLBGAA
SCHEMBL814181 0.81 ALDH1A1 (0.40) MAPTKDM4EALDH1A1LMNAPOLB
SCHEMBL814053 0.81 ALDH1A1 (0.33) MAPTKDM4EALDH1A1LMNAMEN1
SCHEMBL12460048 0.80 RAB9A (0.35) MAPTKDM4EALDH1A1POLBKMT2A
SCHEMBL814230 0.78 GAA (0.45) MAPTKDM4EALDH1A1MEN1POLB
SCHEMBL814656 0.78 KDM4E (0.31) KDM4EALDH1A1POLB
SCHEMBL813913 0.77 ALDH1A1 (0.43) MAPTALDH1A1TP53ALOX15TSHR
SCHEMBL814097 0.77 MEN1 (0.43) MAPTKDM4EALDH1A1LMNAMEN1
SCHEMBL813953 0.77 MEN1 (0.35) MAPTKDM4EALDH1A1MEN1POLB

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
EP-1603957-B1 POLYMERISATION AND OLIGOMERISATION CATALYSTS INEOS SALES UK LTD (GB) 2015-10-28 EP disclosed
EP-1789459-B1 POLYOLEFINS INEOS SALES UK LTD (GB) 2014-04-30 EP disclosed
US-8067328-B2 Polymerisation and oligomerisation catalysts INEOS EUROPE LIMITED (GB) 2011-11-29 US disclosed
US-8067328-B2 Polymerisation and oligomerisation catalysts INEOS EUROPE LIMITED (GB) 2011-11-29 US disclosed
US-7989565-B2 Polyolefins INEOS EUROPE LIMITED (GB) 2011-08-02 US disclosed
US-7989565-B2 Polyolefins INEOS EUROPE LIMITED (GB) 2011-08-02 US disclosed
US-20090124487-A1 Polyolefins BARCLAYS BANK PLC (GB) 2009-05-14 US disclosed
US-20090124487-A1 Polyolefins BARCLAYS BANK PLC (GB) 2009-05-14 US disclosed
US-20070207918-A1 Polymerisation and Oligomerisation Catalysts INEOS SALES (UK) LIMITED (GB) 2007-09-06 US disclosed
US-20070207918-A1 Polymerisation and Oligomerisation Catalysts INEOS SALES (UK) LIMITED (GB) 2007-09-06 US disclosed
US-7229943-B2 Polymerisation and oligomerisation catalysts INNOVENE EUROPE LIMITED (GB) 2007-06-12 US disclosed
US-7229943-B2 Polymerisation and oligomerisation catalysts INNOVENE EUROPE LIMITED (GB) 2007-06-12 US disclosed