SCHEMBL5357869

SCHEMBL5357869

NCCCCCC(=O)NCCCNCCCCNCCCN

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PAOX Q6QHF9 3/20 0.59
SLC6A5 Q9Y345 2/20 0.58
HDAC6 Q9UBN7 2/20 0.54
CA12 O43570 3/20 0.52
CA2 P00918 3/20 0.52
CA4 P22748 3/20 0.52
CA6 P23280 3/20 0.52
CA5A P35218 3/20 0.52
CA7 P43166 3/20 0.52
CA9 Q16790 3/20 0.52
CA14 Q9ULX7 3/20 0.52
CA5B Q9Y2D0 3/20 0.52
F13A1 P00488 2/20 0.52
CYP1A2 P05177 2/20 0.52
ALOX15 P16050 2/20 0.52
THPO P40225 2/20 0.52
CA1 P00915 2/20 0.52
CA3 P07451 2/20 0.52
CYP2C9 P11712 1/20 0.52
PKM P14618 1/20 0.52

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
SCHEMBL12085489 0.92 PAOX (0.53) PAOXSLC6A5HDAC6CA12CA2
SCHEMBL15081399 0.91 SLC6A5 (0.54) PAOXSLC6A5HDAC6CA12CA2
SCHEMBL18507254 0.90 PAOX (0.50) PAOXSLC6A5HDAC6CA12CA2
SCHEMBL12863577 0.90 SLC6A5 (0.67) PAOXSLC6A5ALOX15LMNASMN1; SMN2
SCHEMBL7209833 0.90 SLC6A5 (0.67) PAOXSLC6A5ALOX15LMNASMN1; SMN2
SCHEMBL7208464 0.90 SLC6A5 (0.67) PAOXSLC6A5ALOX15LMNASMN1; SMN2
SCHEMBL7203302 0.90 SLC6A5 (0.67) PAOXSLC6A5ALOX15LMNASMN1; SMN2
SCHEMBL7215946 0.90 SLC6A5 (0.67) PAOXSLC6A5ALOX15LMNASMN1; SMN2
SCHEMBL7215984 0.90 SLC6A5 (0.67) PAOXSLC6A5ALOX15LMNASMN1; SMN2
SCHEMBL17373920 0.90 SLC6A5 (0.67) PAOXSLC6A5ALOX15LMNASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1867633-A1 Polyamine analogues as therapeutic and diagnostic agents MediQuest Therapeutics, Inc. (US) 2007-12-19 EP disclosed
EP-1867633-A1 Polyamine analogues as therapeutic and diagnostic agents MediQuest Therapeutics, Inc. (US) 2007-12-19 EP disclosed
US-7208528-B1 Polyamine analogues as therapeutic and diagnostic agents MEDIQUEST THERAPEUTICS, INC. (US) 2007-04-24 US disclosed
US-7208528-B1 Polyamine analogues as therapeutic and diagnostic agents MEDIQUEST THERAPEUTICS, INC. (US) 2007-04-24 US disclosed
US-7208528-B1 Polyamine analogues as therapeutic and diagnostic agents MEDIQUEST THERAPEUTICS, INC. (US) 2007-04-24 US disclosed
US-7160923-B1 Polyamine analogues as therapeutic and diagnostic agents MEDIQUEST THERAPEUTICS, INC. (US) 2007-01-09 US disclosed
US-7160923-B1 Polyamine analogues as therapeutic and diagnostic agents MEDIQUEST THERAPEUTICS, INC. (US) 2007-01-09 US disclosed
US-7160923-B1 Polyamine analogues as therapeutic and diagnostic agents MEDIQUEST THERAPEUTICS, INC. (US) 2007-01-09 US disclosed
EP-1085011-A1 Novel polyamine analogues as therapeutic and diagnostic agents ORIDIGM CORPORATION (US) 2001-03-21 EP disclosed
US-6172261-B1 BIOSYNTHESIS USING CHAIN EXTENSION ORIDIGM CORPORATION 2001-01-09 US disclosed