SCHEMBL814334

SCHEMBL814334

CC(C)c1cccc(C(C)C)c1/N=C/c1nc2c(-c3ccccc3)ccc(-c3ccccc3)c2n1C

nearest known ligand 0.32

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.32
RARA P10276 1/20 0.32
ALDH1A1 P00352 2/20 0.31
KDM4E B2RXH2 1/20 0.31
POLB P06746 1/20 0.31
HPGD P15428 1/20 0.31
HTT P42858 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
HRH4 Q9H3N8 1/20 0.30
ALOX15 P16050 1/20 0.30
TSHR P16473 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 0.81 MAPT (0.36) GAAALDH1A1KDM4EPOLBHPGD
SCHEMBL814091 0.80 PSMB5 (0.36) GAAALDH1A1KDM4EPOLBHPGD
SCHEMBL814053 0.79 ALDH1A1 (0.33) GAAALDH1A1KDM4EPOLBHPGD
SCHEMBL12460048 0.79 RAB9A (0.35) GAAALDH1A1KDM4EPOLBHPGD
SCHEMBL814230 0.78 GAA (0.45) GAAALDH1A1KDM4EPOLBHPGD
SCHEMBL814189 0.78 KDM4E (0.31) ALDH1A1KDM4EPOLBHPGDHTT
SCHEMBL814097 0.78 MEN1 (0.43) GAAALDH1A1KDM4EPOLBHPGD
SCHEMBL814181 0.77 ALDH1A1 (0.40) GAAALDH1A1KDM4EPOLBHPGD
SCHEMBL813791 0.77 NPC1 (0.36) ALDH1A1KDM4EPOLBHPGDHTT
SCHEMBL814742 0.77 MAPT (0.43) GAAALDH1A1KDM4EPOLBHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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