SCHEMBL4935870

SCHEMBL4935870

CCO[Si](C)(CCCN1C(=O)NC(C)(C)C1=O)OCC

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.46
ALDH1A1 P00352 10/20 0.45
SMN1; SMN2 Q16637 3/20 0.45
MAPK1 P28482 1/20 0.45
LMNA P02545 3/20 0.44
GAA P10253 2/20 0.44
HTT P42858 2/20 0.44
TDP1 Q9NUW8 1/20 0.43
PADI4 Q9UM07 1/20 0.43
PLA2G7 Q13093 1/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
KMT2A Q03164 1/20 0.41
HSD17B10 Q99714 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
MAPT P10636 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
SCHEMBL2355896 0.87 ALDH1A1 (0.49) POLBALDH1A1SMN1; SMN2MAPK1LMNA
SCHEMBL9150295 0.80 ALDH1A1 (0.34) ALDH1A1SMN1; SMN2MAPK1LMNAGAA
SCHEMBL11208031 0.78 POLB (0.47) POLBALDH1A1SMN1; SMN2MAPK1LMNA
SCHEMBL4944111 0.77 POLB (0.50) POLBALDH1A1SMN1; SMN2MAPK1LMNA
SCHEMBL11694927 0.77 POLB (0.68) POLBALDH1A1SMN1; SMN2MAPK1LMNA
SCHEMBL4945318 0.76 POLB (0.53) POLBALDH1A1SMN1; SMN2MAPK1LMNA
SCHEMBL5584328 0.76 POLB (0.61) POLBALDH1A1SMN1; SMN2MAPK1LMNA
SCHEMBL11694716 0.75 POLB (0.65) POLBALDH1A1SMN1; SMN2MAPK1LMNA
SCHEMBL9787811 0.75 POLB (0.65) POLBALDH1A1SMN1; SMN2MAPK1LMNA
SCHEMBL14571854 0.73 MGLL (0.50) ALDH1A1SMN1; SMN2MAPK1LMNAHTT

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
EP-1530576-B1 HETEROCYCLIC HALAMINE-SUBSTITUTED SILOXANES FOR USE IN BIOCIDAL COATINGS AND MATERIALS UNIV AUBURN (US) 2008-02-13 EP disclosed
US-20080003438-A1 Heterocyclic siloxanes for use in biocidal coatings and materials AUBURN UNIVERSITY (US) 2008-01-03 US disclosed
US-6969769-B2 N-halamine siloxanes for use in biocidal coatings and materials VANSON HALOSOURCE, INC. (US) 2005-11-29 US disclosed
EP-1530576-A2 HETEROCYCLIC HALAMINE-SUBSTITUTED SILOXANES FOR USE IN BIOCIDAL COATINGS AND MATERIALS Auburn University (US) 2005-05-18 EP disclosed
US-20040127667-A1 N-halamine siloxanes for use in biocidal coatings and materials AUBURN UNIVERSITY 2004-07-01 US disclosed
WO-2003106466-A2 N-HALAMINE SILOXANES FOR USE IN BIOCIDAL COATINGS AND MATERIALS AUBURN UNIVERSITY (US) 2003-12-24 WO disclosed