SCHEMBL813989

SCHEMBL813989

C(=N/c1ccccc1-c1ccccc1)\c1nc2c(-c3ccccc3)ccc(-c3ccccc3)c2[nH]1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 4/20 0.34
HPGD P15428 4/20 0.34
SMN1; SMN2 Q16637 4/20 0.34
KDM4E B2RXH2 4/20 0.34
ALDH1A1 P00352 4/20 0.34
MEN1 O00255 3/20 0.34
KMT2A Q03164 3/20 0.34
NPSR1 Q6W5P4 3/20 0.34
GLA P06280 3/20 0.34
GAA P10253 3/20 0.34
MAPT P10636 3/20 0.34
RAB9A P51151 3/20 0.34
LMNA P02545 2/20 0.34
PKM P14618 1/20 0.32
HTT P42858 1/20 0.32
MAP4K4 O95819 1/20 0.31
CSF1R P07333 1/20 0.31
FGFR1 P11362 1/20 0.31
PDGFRA P16234 1/20 0.31
LTK P29376 1/20 0.31

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
SCHEMBL813790 0.88 MAPT (0.38) NPC1HPGDSMN1; SMN2KDM4EALDH1A1
SCHEMBL814156 0.88 MEN1 (0.32) NPC1SMN1; SMN2ALDH1A1MEN1KMT2A
SCHEMBL813979 0.87 MEN1 (0.44) NPC1HPGDSMN1; SMN2KDM4EALDH1A1
SCHEMBL814354 0.86 ALDH1A1 (0.44) ALDH1A1MAPTADORA3ADORA2AADORA1
SCHEMBL814162 0.86 MAPT (0.38) NPC1HPGDSMN1; SMN2KDM4EALDH1A1
SCHEMBL813915 0.85 ALDH1A1 (0.46) HPGDSMN1; SMN2KDM4EALDH1A1MEN1
SCHEMBL813978 0.85 ALDH1A1 (0.42) NPC1HPGDSMN1; SMN2KDM4EALDH1A1
SCHEMBL813873 0.84 KDM4E (0.43) HPGDKDM4EALDH1A1MEN1KMT2A
SCHEMBL12460354 0.81 RAB9A (0.36) NPC1SMN1; SMN2GAAMAPTRAB9A
SCHEMBL814054 0.80 CNR2 (0.33)

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