SCHEMBL4259356

SCHEMBL4259356

NC(=O)CCCCCCCCCCCCCCCNCC(=O)NCC(=O)O

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAOA P21397 2/20 0.47
MAOB P27338 2/20 0.47
PTPN1 P18031 1/20 0.41
PRMT1 Q99873 1/20 0.41
FAAH O00519 3/20 0.41
ITGB3 P05106 2/20 0.40
ITGA2B P08514 2/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
ADRA1A P35348 1/20 0.39
PLA2G2A P14555 1/20 0.39
PAOX Q6QHF9 1/20 0.37
EPHX2 P34913 2/20 0.36
CA1 P00915 2/20 0.36
CA2 P00918 2/20 0.36

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
SCHEMBL22344277 0.85 MAOA (0.52) MAOAMAOBPRMT1MEN1KMT2A
SCHEMBL25372345 0.83 PTPN1 (0.56) PTPN1FAAHMEN1KMT2APLA2G2A
SCHEMBL25374908 0.83 PTPN1 (0.56) PTPN1FAAHMEN1KMT2APLA2G2A
SCHEMBL25374396 0.83 PTPN1 (0.56) PTPN1FAAHMEN1KMT2APLA2G2A
SCHEMBL3419664 0.80 FAAH (0.53) FAAHMEN1KMT2APLA2G2AEPHX2
SCHEMBL11111411 0.79 MAOA (0.43) MAOAMAOBPRMT1ITGB3ITGA2B
SCHEMBL288952 0.78 MAOA (0.48) MAOAMAOBPRMT1MEN1KMT2A
SCHEMBL13336065 0.78 CA1 (0.45) PTPN1FAAHCA1CA2
SCHEMBL4975630 0.78 FAAH (0.50) FAAHMEN1KMT2APLA2G2AEPHX2
SCHEMBL16384730 0.77 PTPN1 (0.49) PTPN1FAAHITGB3ITGA2BMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090202641-A1 HOLLOW FIBROUS ORGANIC NANOTUBE AND PRODUCTION METHOD THEREOF NATIONAL INSTITUTE OF ADVANCED INDUSTRIAL SCIENCE AND TECHNOLOGY (JP) 2009-08-13 US disclosed