SCHEMBL2198522

SCHEMBL2198522

O=C(Cc1ccccc1)OOC(=O)c1ccccc1

nearest known ligand 0.65

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.65
F2 P00734 1/20 0.65
TDP1 Q9NUW8 3/20 0.53
ALDH1A1 P00352 2/20 0.53
KMT2A Q03164 2/20 0.53
MAPK1 P28482 2/20 0.53
L3MBTL1 Q9Y468 1/20 0.53
SLC6A2 P23975 1/20 0.53
SLC6A3 Q01959 1/20 0.53
PAM P19021 1/20 0.52
TSHR P16473 3/20 0.50
CES2 O00748 1/20 0.48
CES1 P23141 1/20 0.48
AKR1B1 P15121 1/20 0.48
HSD17B10 Q99714 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.46
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45
HIF1A Q16665 1/20 0.44

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
Benzene SCHEMBL9407299 0.88 ALDH1A1 (0.65) ALDH1A1KMT2AMAPK1L3MBTL1PAM
SCHEMBL664857 0.88 ALDH1A1 (0.65) ALDH1A1KMT2AMAPK1L3MBTL1PAM
SCHEMBL6663812 0.84 LMNA (0.71) LMNAF2TDP1ALDH1A1KMT2A
SCHEMBL4879257 0.82 TDP1 (0.55) LMNAF2TDP1ALDH1A1KMT2A
SCHEMBL17261435 0.82 LMNA (0.74) LMNAF2TDP1ALDH1A1KMT2A
SCHEMBL2043895 0.82 CTBP2 (0.53) LMNAF2TDP1KMT2AL3MBTL1
SCHEMBL2877979 0.81 ALDH1A1 (0.63) ALDH1A1KMT2AMAPK1L3MBTL1PAM
Benzoyl Peroxide SCHEMBL63 0.81 LMNA (1.00) LMNAF2TDP1ALDH1A1KMT2A
Benzoyl Peroxide SCHEMBL2929886 0.81 LMNA (1.00) LMNAF2TDP1ALDH1A1KMT2A
Benzoyl Peroxide SCHEMBL5312311 0.81 LMNA (1.00) LMNAF2TDP1ALDH1A1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7740826-B2 Method for functionalizing carbon nanotubes utilizing peroxides WILLIAM MARSH RICE UNIVERSITY (US) 2010-06-22 US claimed
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-20070098620-A1 Method for functionalizing carbon nanotubes utilizing peroxides WILLIAM MARSH RICE UNIVERSITY (US) 2007-05-03 US claimed
US-20040223900-A1 Method for functionalizing carbon nanotubes utilizing peroxides WILLIAM MARSH RICE UNIVERSITY (US) 2004-11-11 US claimed
US-4618647-A TWO POLYMERIZATION CATALYSTS UNION CARBIDE CORP. (US) 1986-10-21 US 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
US-6491903-B1 NARROW MOLECULAR WEIGHT DISTRIBUTION SHELL-CORE POLYMERS HAVING HYDROPHILIC, CROSSLINKED PERMEABLE SHELLS AND HYDROPHOBIC CORES, USED FOR REDUCING BLOOD CHOLESTEROL AND BILE ACID UPTAKE IN INTERSTINES; DRUG DELIVERY WASHINGTON UNIVERSITY 2002-12-10 US disclosed
US-6383500-B1 Particles comprising amphiphilic copolymers, having a crosslinked shell domain and an interior core domain, useful for pharmaceutical and other applications WASHINGTON UNIVERSITY 2002-05-07 US disclosed