SCHEMBL814337

SCHEMBL814337

Cn1c(/C=N/c2ccccc2Sc2ccccc2)nc2ccccc21

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 10/20 0.52
HPGD P15428 5/20 0.50
TP53 P04637 1/20 0.50
ALOX15 P16050 1/20 0.50
TSHR P16473 1/20 0.50
ALDH1A1 P00352 8/20 0.48
HSD17B10 Q99714 1/20 0.48
MAPT P10636 5/20 0.48
NPC1 O15118 4/20 0.48
RAB9A P51151 4/20 0.48
PKM P14618 3/20 0.48
KMT2A Q03164 2/20 0.48
L3MBTL1 Q9Y468 2/20 0.48
GAA P10253 2/20 0.46
POLB P06746 2/20 0.45
HTT P42858 2/20 0.45
TDP1 Q9NUW8 2/20 0.45
ATM Q13315 1/20 0.43
SMN1; SMN2 Q16637 4/20 0.42
MEN1 O00255 1/20 0.42

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
SCHEMBL814682 0.85 KDM4E (0.56) KDM4EHPGDTP53ALOX15TSHR
SCHEMBL814014 0.78 KDM4E (0.60) KDM4EHPGDTP53ALOX15TSHR
SCHEMBL814177 0.77 KDM4E (0.56) KDM4EHPGDTP53ALOX15TSHR
SCHEMBL814513 0.77 KDM4E (0.59) KDM4EHPGDTP53ALOX15TSHR
SCHEMBL813872 0.76 HPGD (0.45) KDM4EHPGDALOX15TSHRALDH1A1
SCHEMBL813793 0.76 KDM4E (0.66) KDM4EHPGDTP53ALOX15TSHR
SCHEMBL813896 0.76 KDM4E (0.57) KDM4EHPGDTP53ALOX15TSHR
SCHEMBL814116 0.75 KDM4E (0.56) KDM4EHPGDTP53ALOX15TSHR
SCHEMBL814114 0.75 KDM4E (0.56) KDM4EHPGDTP53ALOX15TSHR
SCHEMBL16101976 0.75 KDM4E (0.56) KDM4EHPGDTP53ALOX15TSHR

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