SCHEMBL2201028

SCHEMBL2201028

O=C(OOC(=O)C1CC2C=CC1C2)C1CC2C=CC1C2

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.57
KDM4E B2RXH2 2/20 0.57
ALDH1A1 P00352 9/20 0.44
KMT2A Q03164 3/20 0.43
RAB9A P51151 1/20 0.43
POLB P06746 2/20 0.42
HSD17B10 Q99714 2/20 0.42
APEX1 P27695 1/20 0.42
RECQL P46063 1/20 0.42
BLM P54132 1/20 0.42
ESR2 Q92731 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
HPGD P15428 1/20 0.42
THRB P10828 1/20 0.37
EPHX2 P34913 3/20 0.36
MAPK1 P28482 2/20 0.35
MAPT P10636 1/20 0.34
MEN1 O00255 1/20 0.34
ALOX15 P16050 1/20 0.34

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
SCHEMBL2776167 0.87 LMNA (0.57) LMNAKDM4EALDH1A1KMT2ARAB9A
SCHEMBL14378676 0.87 LMNA (0.57) LMNAKDM4EALDH1A1KMT2ARAB9A
SCHEMBL2775560 0.83 LMNA (0.53) LMNAKDM4EALDH1A1KMT2ARAB9A
SCHEMBL75461 0.83 KDM4E (0.58) LMNAKDM4EALDH1A1KMT2ARAB9A
SCHEMBL13714939 0.83 KDM4E (0.58) LMNAKDM4EALDH1A1KMT2ARAB9A
SCHEMBL23016645 0.83 KDM4E (0.58) LMNAKDM4EALDH1A1KMT2ARAB9A
SCHEMBL11509527 0.83 KDM4E (0.58) LMNAKDM4EALDH1A1KMT2ARAB9A
SCHEMBL24908346 0.83 KDM4E (0.58) LMNAKDM4EALDH1A1KMT2ARAB9A
SCHEMBL19220253 0.83 KDM4E (0.58) LMNAKDM4EALDH1A1KMT2ARAB9A
SCHEMBL29483886 0.83 KDM4E (0.58) LMNAKDM4EALDH1A1KMT2ARAB9A

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 16 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
WO-2017173975-A1 METHOD FOR SYNTHESIZING COMPOUND CONTAINING NON-TERMINAL DOUBLE BOND 中国科学院福建物质结构研究所 2017-10-12 WO disclosed
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