SCHEMBL12112846

SCHEMBL12112846

O=C(CCc1ccc(N(c2ccc(CCC(=O)OCCCS)cc2)c2ccc(-c3ccccc3)cc2)cc1)OCCCS

nearest known ligand 0.54

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.54
FFAR1 O14842 2/20 0.47
APP P05067 1/20 0.45
MGLL Q99685 5/20 0.44
MMP12 P39900 1/20 0.43
LPAR1 Q92633 2/20 0.40
ALOX5 P09917 1/20 0.40

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
SCHEMBL14129383 0.88 TDP1 (0.54) TDP1FFAR1APPMGLL
SCHEMBL13410149 0.86 TDP1 (0.58) TDP1FFAR1APPMGLLMMP12
SCHEMBL24372552 0.85 LMNA (0.46) TDP1FFAR1MGLL
SCHEMBL24372731 0.82 MGLL (0.46) FFAR1MGLLLPAR1
SCHEMBL12111781 0.82 TDP1 (0.47) TDP1FFAR1APPMGLLALOX5
SCHEMBL14281444 0.81 TDP1 (0.52) TDP1FFAR1APPMGLLMMP12
SCHEMBL14540241 0.81 TDP1 (0.63) TDP1FFAR1APPMGLLMMP12
SCHEMBL14172861 0.81 TDP1 (0.44) TDP1FFAR1APPMGLL
SCHEMBL2602489 0.81 TDP1 (0.51) TDP1FFAR1APPMGLLMMP12
SCHEMBL12744759 0.81 TDP1 (0.51) TDP1FFAR1APPMGLLMMP12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8055153-B2 Image forming apparatus and process cartridge FUJI XEROX CO., LTD. (JP) 2011-11-08 US disclosed
US-7713499-B2 Fluidized bed reaction apparatus and methods for using the same XEROX CORPORATION (US) 2010-05-11 US disclosed
US-7517928-B2 Siloxane-acrylate interpenetrating networks and methods for producing the same XEROX CORPORATION (US) 2009-04-14 US disclosed
US-20080089712-A1 Image forming apparatus and process cartridge FUJI XEROX CO., LTD. (JP) 2008-04-17 US disclosed
US-7348447-B2 Aromatic disiloxane compositions XEROX CORPORATION (US) 2008-03-25 US disclosed
US-7332630-B2 preparation of a tertiary arylamine compound, comprising reacting an arylhalide and an arylamine in the presence of an alkylene glycol compound and a catalyst; use of such compounds in electrophotographic imaging members XEROX CORPORATION (US) 2008-02-19 US disclosed