SCHEMBL813867

SCHEMBL813867

C(=N/Cc1ccccc1)\c1nc2ccccc2[nH]1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.52
ALDH1A1 P00352 5/20 0.52
HPGD P15428 5/20 0.52
RAB9A P51151 10/20 0.51
NPC1 O15118 9/20 0.51
SMN1; SMN2 Q16637 8/20 0.51
MEN1 O00255 4/20 0.51
KMT2A Q03164 4/20 0.51
PKM P14618 2/20 0.51
HSP90AA1 P07900 1/20 0.51
GAA P10253 7/20 0.49
MAPT P10636 5/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
TP53 P04637 2/20 0.45
HTT P42858 3/20 0.44
HSD17B10 Q99714 1/20 0.44
AR P10275 1/20 0.44
LMNA P02545 2/20 0.43
GLA P06280 1/20 0.43
NFKB1 P19838 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
SCHEMBL813968 0.79 RAB9A (0.53) KDM4EALDH1A1HPGDRAB9ANPC1
SCHEMBL813924 0.77 ALDH1A1 (0.51) KDM4EALDH1A1HPGDRAB9ANPC1
SCHEMBL813900 0.77 ALDH1A1 (0.51) KDM4EALDH1A1HPGDRAB9ANPC1
SCHEMBL5608753 0.76 ALDH1A1 (0.45) KDM4EALDH1A1HPGDRAB9ANPC1
SCHEMBL5608749 0.76 ALDH1A1 (0.45) KDM4EALDH1A1HPGDRAB9ANPC1
SCHEMBL10957656 0.76 ALDH1A1 (0.61) KDM4EALDH1A1HPGDRAB9ANPC1
SCHEMBL6185354 0.76 ALDH1A1 (0.61) KDM4EALDH1A1HPGDRAB9ANPC1
SCHEMBL6185357 0.76 ALDH1A1 (0.61) KDM4EALDH1A1HPGDRAB9ANPC1
SCHEMBL5627161 0.76 RAB9A (0.56) KDM4EALDH1A1HPGDRAB9ANPC1
SCHEMBL15267615 0.75 ALDH1A1 (0.59) KDM4EALDH1A1HPGDRAB9ANPC1

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