SCHEMBL814728

SCHEMBL814728

Cn1c(/C=N/C23CC4CC(CC(C4)C2)C3)nc2ccccc21

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 8/20 0.55
ALDH1A1 P00352 7/20 0.50
HPGD P15428 5/20 0.50
HSD17B10 Q99714 1/20 0.50
MAPT P10636 4/20 0.47
KMT2A Q03164 3/20 0.47
NPC1 O15118 3/20 0.47
RAB9A P51151 3/20 0.47
PKM P14618 2/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
SMN1; SMN2 Q16637 4/20 0.46
MEN1 O00255 2/20 0.46
NPSR1 Q6W5P4 1/20 0.46
TP53 P04637 1/20 0.46
ALOX15 P16050 1/20 0.46
TSHR P16473 1/20 0.46
POLB P06746 2/20 0.44
HTT P42858 2/20 0.44
TDP1 Q9NUW8 2/20 0.44
ADAMTS5 Q9UNA0 1/20 0.43

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
Amantadine SCHEMBL15013442 0.76 KDM4E (0.48) KDM4EALDH1A1HPGDHSD17B10MAPT
SCHEMBL3364005 0.76 GRIN2D (0.48) KMT2ANPC1RAB9ASMN1; SMN2MEN1
SCHEMBL3363998 0.76 GRIN2D (0.48) KMT2ANPC1RAB9ASMN1; SMN2MEN1
SCHEMBL30792923 0.74 HSD11B1 (0.52) KDM4EHPGDKMT2ANPC1RAB9A
SCHEMBL17995255 0.74 HSD11B1 (0.52) KDM4EHPGDKMT2ANPC1RAB9A
SCHEMBL12460834 0.73 KDM4E (0.72) KDM4EALDH1A1HPGDHSD17B10MAPT
SCHEMBL813918 0.73 KDM4E (0.62) KDM4EALDH1A1HPGDHSD17B10MAPT
SCHEMBL813985 0.72 KDM4E (0.66) KDM4EALDH1A1HPGDHSD17B10MAPT
SCHEMBL5212985 0.71 KDM4E (1.00) KDM4EALDH1A1HPGDHSD17B10MAPT
SCHEMBL6852240 0.71 KDM4E (0.68) KDM4EALDH1A1HPGDHSD17B10MAPT

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