SCHEMBL5405789

SCHEMBL5405789

CCCCNCC(O)COC1CC(C)(C)N(O)C(C)(C)C1

nearest known ligand 0.36

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.32
MEN1 O00255 1/20 0.31
HTT P42858 1/20 0.31
KMT2A Q03164 1/20 0.31
TOP2A P11388 1/20 0.30

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
SCHEMBL13202049 0.89 MEN1 (0.33) KDM4EMEN1HTTKMT2A
SCHEMBL5405785 0.88 TOP2A (0.31) KDM4EMEN1HTTKMT2ATOP2A
SCHEMBL7211170 0.86 MEN1 (0.30) MEN1HTTKMT2A
SCHEMBL12468548 0.78 GAA (0.32) MEN1HTTKMT2A
SCHEMBL4387071 0.78 MEN1 (0.33) KDM4EMEN1HTTKMT2A
SCHEMBL13202053 0.78 MEN1 (0.33) KDM4EMEN1HTTKMT2A
SCHEMBL13202064 0.75 MEN1 (0.30) MEN1HTTKMT2A
SCHEMBL2025232 0.75 GAA (0.33) MEN1HTTKMT2A
SCHEMBL7515898 0.75 LMNA (0.43) MEN1KMT2A
SCHEMBL7512516 0.75 HIF1A (0.33) MEN1HTTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7312332-B2 Such as 1-butyl-3-hydroxy-1-[2-hydroxy-3-(1-oxyl-2,2,6,6-tetramethyl-piperidin-4-yloxy)-propyl]-azetidinium chloride; yellowing and discoloration prevention; ultraviolet, fluorescent and solar light stability; expanding use of high yield pulps to higher grade products CIBA SPECIALTY CHEMICALS CORPORATION (US) 2007-12-25 US disclosed
US-7312332-B2 Such as 1-butyl-3-hydroxy-1-[2-hydroxy-3-(1-oxyl-2,2,6,6-tetramethyl-piperidin-4-yloxy)-propyl]-azetidinium chloride; yellowing and discoloration prevention; ultraviolet, fluorescent and solar light stability; expanding use of high yield pulps to higher grade products CIBA SPECIALTY CHEMICALS CORPORATION (US) 2007-12-25 US disclosed
US-6989449-B1 Chlorohydrin and cationic compounds having high affinity for pulp or paper CIBA SPECIALTY CHEMICALS CORPORATION (US) 2006-01-24 US disclosed
US-20050092452-A1 Chlorohydrin and cationic compounds having high affinity for pulp or paper CUNKLE GLEN T (US) 2005-05-05 US disclosed
EP-1212486-B1 CHLOROHYDRIN AND CATIONIC COMPOUNDS HAVING HIGH AFFINITY FOR PULP OR PAPER CIBA SC HOLDING AG (CH) 2005-04-06 EP disclosed
EP-1212486-A1 CHLOROHYDRIN AND CATIONIC COMPOUNDS HAVING HIGH AFFINITY FOR PULP OR PAPER Ciba SC Holding AG (CH) 2002-06-12 EP disclosed
WO-2001020078-A1 CHLOROHYDRIN AND CATIONIC COMPOUNDS HAVING HIGH AFFINITY FOR PULP OR PAPER CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2001-03-22 WO disclosed