SCHEMBL814192

SCHEMBL814192

CN(C)CC/N=C/c1nc2c(-c3ccccc3)ccc(-c3ccccc3)c2n1C

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.35
KDM4E B2RXH2 5/20 0.35
KMT2A Q03164 3/20 0.35
MEN1 O00255 2/20 0.35
MAP1LC3B Q9GZQ8 2/20 0.34
LMNA P02545 2/20 0.33
MAPT P10636 2/20 0.33
POLB P06746 1/20 0.33
TSHR P16473 1/20 0.33
HTT P42858 1/20 0.33
HTR7 P34969 2/20 0.33
TLR9 Q9NR96 1/20 0.32
HPGD P15428 3/20 0.31
HSD17B10 Q99714 3/20 0.31
ALOX15 P16050 2/20 0.31
HEXA P06865 1/20 0.31
HEXB P07686 1/20 0.31
NPC1 O15118 1/20 0.30
MAPK1 P28482 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
SCHEMBL813773 0.85 ADK (0.33) ALDH1A1KMT2AMEN1LMNAMAPT
SCHEMBL813930 0.82 LMNA (0.35) ALDH1A1KDM4ELMNAMAPT
SCHEMBL814180 0.82 LMNA (0.32) ALDH1A1LMNAPOLB
SCHEMBL813868 0.81 MAPT (0.40) ALDH1A1KDM4EKMT2AMEN1LMNA
SCHEMBL813791 0.81 NPC1 (0.36) ALDH1A1KDM4EPOLBHTTHPGD
SCHEMBL12460048 0.79 RAB9A (0.35) ALDH1A1KDM4EKMT2AMAPTPOLB
SCHEMBL814526 0.77 MAPT (0.36) ALDH1A1KDM4EKMT2AMEN1LMNA
SCHEMBL813953 0.76 MEN1 (0.35) ALDH1A1KDM4EKMT2AMEN1MAPT
SCHEMBL814181 0.76 ALDH1A1 (0.40) ALDH1A1KDM4ELMNAMAPTPOLB
SCHEMBL813758 0.76 KDM4E (0.31) ALDH1A1KDM4EPOLBHTTHPGD

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 11 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-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