Cetrimonium

Cetrimonium

SCHEMBL6738402

CC=O.CCCCCCCCCCCCCCCC[N+](C)(C)C

nearest known ligand 0.75

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 8/20 0.75
APAF1 O14727 1/20 0.68
HSP90AA1 P07900 1/20 0.68
RAD52 P43351 1/20 0.68
MEN1 O00255 4/20 0.55
KMT2A Q03164 4/20 0.55
APEX1 P27695 3/20 0.55
NFKB1 P19838 2/20 0.55
KDM4E B2RXH2 2/20 0.55
ACHE P22303 2/20 0.55
SMN1; SMN2 Q16637 2/20 0.55
PMP22 Q01453 2/20 0.55
LMNA P02545 2/20 0.55
HSD17B10 Q99714 1/20 0.55
HRH3 Q9Y5N1 1/20 0.55
TSHR P16473 1/20 0.55
RAB9A P51151 1/20 0.55
NPSR1 Q6W5P4 1/20 0.52
HTT P42858 1/20 0.52
SLC22A1 O15245 1/20 0.50

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
Acetaldehyde SCHEMBL11424974 1.00 DNM1 (0.75) DNM1APAF1HSP90AA1RAD52MEN1
Acetaldehyde SCHEMBL11428896 1.00 DNM1 (0.75) DNM1APAF1HSP90AA1RAD52MEN1
Acetaldehyde SCHEMBL11414364 1.00 DNM1 (0.75) DNM1APAF1HSP90AA1RAD52MEN1
Formic Acid SCHEMBL5573603 0.88 DNM1 (0.71) DNM1APAF1HSP90AA1RAD52MEN1
Formic Acid SCHEMBL2533288 0.88 DNM1 (0.71) DNM1APAF1HSP90AA1RAD52MEN1
Cetrimonium SCHEMBL4817929 0.88 DNM1 (0.71) DNM1APAF1HSP90AA1RAD52MEN1
Propionaldehyde SCHEMBL11421413 0.88 DNM1 (0.71) DNM1APAF1HSP90AA1RAD52MEN1
Formic Acid SCHEMBL2533294 0.88 DNM1 (0.71) DNM1APAF1HSP90AA1RAD52MEN1
Propionaldehyde SCHEMBL11416961 0.88 DNM1 (0.71) DNM1APAF1HSP90AA1RAD52MEN1
Formic Acid SCHEMBL5570526 0.88 DNM1 (0.71) DNM1APAF1HSP90AA1RAD52MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040198884-A1 Polycarbonate composition with excellent releasability from mold TEIJIN LIMITED (JP) 2004-10-07 US disclosed
US-20040147655-A1 Aromatic polycarbonate resin composition TEIJIN LIMITED (JP) 2004-07-29 US disclosed
US-6696541-B1 RAPIDLY AND EASILY FORMING HIGH MOLECULAR WEIGHT RESIN HAVING EXCELLENT COLOR TONE AND LESS GEL TEIJIN LIMITED (JP) 2004-02-24 US disclosed
US-20040034130-A1 An aromatic polycarbonate (obtained by reacting an aromatic dihydroxy compound with a carbonic acid diester) using an ester exchange catalyst selected form alkali or alkaline metal compound; an epoxy compound; and an aromatic compound TEIJIN LIMITED (JP) 2004-02-19 US disclosed
US-6509435-B1 Heat resistance, stability; moldings TEIJIN LIMITED (JP) 2003-01-21 US disclosed
EP-1275694-A1 AROMATIC POLYCARBONATE COMPOSITION, PROCESS FOR PRODUCING THE SAME, AND MOLDED ARTICLE THEREOF TEIJIN LIMITED (JP) 2003-01-15 EP disclosed
EP-1245607-A1 METHOD OF CRYSTALLIZING LOW-MOLECULAR POLYCARBONATE AND PROCESS FOR PRODUCING POLYCARBONATE RESIN FROM THE SAME TEIJIN LIMITED (JP) 2002-10-02 EP disclosed
US-6423813-B1 FROM PHENOLIC COMPOUNDS TEIJIN LIMITED (JP) 2002-07-23 US disclosed
US-6410678-B1 HYDROXYL END GROUPS TEIJIN LIMITED (JP) 2002-06-25 US disclosed
EP-1191049-A1 POLYCARBONATE, PROCESS FOR PRODUCING THE SAME, AND MOLDED ARTICLE THEREOF TEIJIN LIMITED (JP) 2002-03-27 EP disclosed
EP-1179556-A1 BRANCHED AROMATIC POLYCARBONATE, PROCESS FOR PRODUCING THE SAME, AND BLOW-MOLDED ARTICLE THEREOF TEIJIN LIMITED (JP) 2002-02-13 EP disclosed
EP-1149852-A1 AROMATIC POLYCARBONATE, PROCESS FOR PRODUCING THE SAME, AND MOLDED ARTICLE TEIJIN LIMITED (JP) 2001-10-31 EP disclosed
US-4209643-A Preparation of acetals ETHYL CORPORATION (US) 1980-06-24 US disclosed