SCHEMBL3177102

SCHEMBL3177102

CCCC[n+]1ccn(C)c1CC

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 3/20 0.41
CA2 P00918 3/20 0.41
MEN1 O00255 4/20 0.33
KMT2A Q03164 4/20 0.33
EEF2K O00418 2/20 0.33
EEF2 P13639 2/20 0.33
PLK4 O00444 1/20 0.33
JAK2 O60674 1/20 0.33
EGFR P00533 1/20 0.33
TYK2 P29597 1/20 0.33
FLT3 P36888 1/20 0.33
BLM P54132 1/20 0.33
ITK Q08881 1/20 0.33
PIM2 Q9P1W9 1/20 0.33
NPC1 O15118 2/20 0.31
HSP90AA1 P07900 2/20 0.31
MAPK1 P28482 2/20 0.31
HTT P42858 2/20 0.31
RAB9A P51151 2/20 0.31
SMN1; SMN2 Q16637 2/20 0.31

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
Bromide SCHEMBL1534001 0.98 CA1 (0.44) CA1CA2MEN1KMT2AEEF2K
SCHEMBL5296928 0.94 CA1 (0.47) CA1CA2MEN1KMT2AEEF2K
SCHEMBL5816911 0.93 CA1 (0.50) CA1CA2MEN1KMT2AEEF2K
SCHEMBL5285264 0.93 CA1 (0.50) CA1CA2MEN1KMT2AEEF2K
SCHEMBL5298488 0.93 CA1 (0.50) CA1CA2MEN1KMT2AEEF2K
SCHEMBL5289251 0.93 CA1 (0.50) CA1CA2MEN1KMT2AEEF2K
SCHEMBL5290439 0.93 CA1 (0.50) CA1CA2MEN1KMT2AEEF2K
SCHEMBL5290080 0.93 CA1 (0.50) CA1CA2MEN1KMT2AEEF2K
SCHEMBL5301534 0.93 CA1 (0.50) CA1CA2MEN1KMT2AEEF2K
SCHEMBL5299084 0.93 CA1 (0.50) CA1CA2MEN1KMT2AEEF2K

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112473744-B Front-rear stage two-section type combined catalyst and application thereof 浙江工业大学 2021-11-30 CN disclosed
CN-112473744-A Front-rear stage two-section type combined catalyst and application thereof 浙江工业大学 2021-03-12 CN disclosed
CN-111804331-A Homogeneous catalyst and heterogeneous catalyst based on ionic liquid, and preparation method and application thereof 沈阳化工大学 2020-10-23 CN disclosed
US-7645438-B2 Process for the production of hydrogen peroxide AKZO NOBEL N.V. (NL) 2010-01-12 US disclosed
EP-2038215-A1 PROCESS FOR THE PRODUCTION OF HYDROGEN PEROXIDE Akzo Nobel N.V. (NL) 2009-03-25 EP disclosed
US-20080044343-A1 Process for the production of hydrogen peroxide AKZO NOBEL N.V. (NL) 2008-02-21 US disclosed
WO-2008002255-A1 PROCESS FOR THE PRODUCTION OF HYDROGEN PEROXIDE AKZO NOBEL N.V. (NL) 2008-01-03 WO disclosed
WO-2007006418-A1 IONIC-LIQUID-CONTAINING PRODUCTS FOR DYEING AND/OR BRIGHTENING KERATIN FIBRES HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2007-01-18 WO disclosed
WO-2006131234-A1 COSMETIC COMPOSITIONS COMPRISING IONIC LIQUIDS HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2006-12-14 WO disclosed