SCHEMBL814097

SCHEMBL814097

Cn1c(/C=N/c2cccc3ccccc23)nc2c(-c3ccccc3)ccc(-c3ccccc3)c21

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 9/20 0.43
KMT2A Q03164 9/20 0.43
MAPT P10636 8/20 0.43
ALDH1A1 P00352 8/20 0.43
KDM4E B2RXH2 7/20 0.43
L3MBTL1 Q9Y468 6/20 0.43
TDP1 Q9NUW8 4/20 0.43
DHODH Q02127 2/20 0.41
CHAT P28329 1/20 0.40
POLB P06746 3/20 0.39
LMNA P02545 3/20 0.39
HSP90AA1 P07900 1/20 0.39
ATM Q13315 2/20 0.36
APAF1 O14727 1/20 0.36
SAE1 Q9UBE0 1/20 0.36
UBA2 Q9UBT2 1/20 0.36
HRH4 Q9H3N8 1/20 0.35
HPGD P15428 4/20 0.35
RECQL P46063 2/20 0.34
NPSR1 Q6W5P4 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
SCHEMBL814053 0.88 ALDH1A1 (0.33) MEN1KMT2AMAPTALDH1A1KDM4E
SCHEMBL814181 0.85 ALDH1A1 (0.40) MAPTALDH1A1KDM4EL3MBTL1TDP1
SCHEMBL813913 0.83 ALDH1A1 (0.43) MAPTALDH1A1ALOX15TSHR
SCHEMBL813780 0.82 ALDH1A1 (0.41) MEN1KMT2AMAPTALDH1A1KDM4E
SCHEMBL814356 0.82 ALDH1A1 (0.46) MEN1KMT2AMAPTALDH1A1KDM4E
SCHEMBL814526 0.82 MAPT (0.36) MEN1KMT2AMAPTALDH1A1KDM4E
SCHEMBL813872 0.81 HPGD (0.45) MEN1KMT2AMAPTALDH1A1KDM4E
SCHEMBL12460048 0.79 RAB9A (0.35) KMT2AMAPTALDH1A1KDM4EL3MBTL1
SCHEMBL814334 0.78 GAA (0.32) ALDH1A1KDM4ETDP1POLBHRH4
SCHEMBL813713 0.77 MAPT (0.34) MEN1KMT2AMAPTALDH1A1KDM4E

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