SCHEMBL2199876

SCHEMBL2199876

O=C(CCCBr)OOC(=O)CCCBr

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.41
LMNA P02545 3/20 0.36
ALDH1A1 P00352 2/20 0.36
KDM4E B2RXH2 1/20 0.36
MEN1 O00255 1/20 0.36
USP2 O75604 1/20 0.36
CYP3A4 P08684 1/20 0.36
HPGD P15428 1/20 0.36
KMT2A Q03164 1/20 0.36
HSD17B10 Q99714 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
DGKA P23743 1/20 0.32
CYP1A2 P05177 1/20 0.32
TRPA1 O75762 1/20 0.32
NAAA Q02083 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
SCHEMBL3173473 0.81 ALDH1A1 (0.48) TSHRLMNAALDH1A1KDM4EMEN1
SCHEMBL21811919 0.79 DGKA (0.41) TSHRLMNAALDH1A1KDM4EMEN1
SCHEMBL9402714 0.78 TSHR (0.36) TSHRALDH1A1HSD17B10TDP1
SCHEMBL260980 0.77
SCHEMBL18023121 0.77
SCHEMBL20573319 0.77 DGKA (0.56) TSHRLMNAALDH1A1TDP1DGKA
SCHEMBL24246432 0.75 TSHR (0.36) TSHRLMNAALDH1A1KDM4EMEN1
SCHEMBL13551135 0.75 DGKA (0.48) TSHRALDH1A1TDP1DGKACYP1A2
SCHEMBL540009 0.73 LMNA (0.39) TSHRLMNAALDH1A1KDM4EMEN1
SCHEMBL6659663 0.73 GPR84 (0.50) TSHRLMNAKDM4EMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090306427-A1 Chemical Functionalization of Carbon Nanotubes NATIONAL RESEARCH COUNCIL OF CANADA (CA) 2009-12-10 US claimed
EP-1989143-A1 CHEMICAL FUNCTIONALIZATION OF CARBON NANOTUBES National Research Council of Canada (CA) 2008-11-12 EP claimed
WO-2007098578-A1 CHEMICAL FUNCTIONALIZATION OF CARBON NANOTUBES NATIONAL RESEARCH COUNCIL OF CANADA (CA) 2007-09-07 WO claimed
US-7976816-B2 Method for functionalizating carbon naontubes utilizing peroxides WILLIAM MARSH RICE UNIVERSITY (US) 2011-07-12 US disclosed
US-20100222536-A1 Method for Functionalizating Carbon Naontubes Utilizing Peroxides WILLIAM MARSH RICE UNIVERSITY (US) 2010-09-02 US disclosed
US-7740826-B2 Method for functionalizing carbon nanotubes utilizing peroxides WILLIAM MARSH RICE UNIVERSITY (US) 2010-06-22 US disclosed
US-20090306427-A1 Chemical Functionalization of Carbon Nanotubes NATIONAL RESEARCH COUNCIL OF CANADA (CA) 2009-12-10 US disclosed
EP-1989143-A1 CHEMICAL FUNCTIONALIZATION OF CARBON NANOTUBES National Research Council of Canada (CA) 2008-11-12 EP disclosed
WO-2007098578-A1 CHEMICAL FUNCTIONALIZATION OF CARBON NANOTUBES NATIONAL RESEARCH COUNCIL OF CANADA (CA) 2007-09-07 WO disclosed
US-20070098620-A1 Method for functionalizing carbon nanotubes utilizing peroxides WILLIAM MARSH RICE UNIVERSITY (US) 2007-05-03 US disclosed
US-7125533-B2 decomposing an acyl peroxide to form carbon-centered free radicals and reacting the carbon-centered free radicals with the carbon nanotube to form a functionalized carbon nanotube WILLIAM MARSH RICE UNIVERSITY (US) 2006-10-24 US disclosed
US-20040223900-A1 Method for functionalizing carbon nanotubes utilizing peroxides WILLIAM MARSH RICE UNIVERSITY (US) 2004-11-11 US disclosed