SCHEMBL27619014

SCHEMBL27619014

Nc1cccc2c(C(=O)c3nccc4c(N)cccc34)nccc12

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.48
CYP3A4 P08684 3/20 0.48
TDP1 Q9NUW8 2/20 0.48
HPGD P15428 2/20 0.48
TSHR P16473 2/20 0.48
HSD17B10 Q99714 2/20 0.48
NCOA1 Q15788 1/20 0.42
NCOA3 Q9Y6Q9 1/20 0.42
TTR P02766 1/20 0.42
KDM4E B2RXH2 1/20 0.42
MEN1 O00255 1/20 0.42
USP2 O75604 1/20 0.42
TDP2 O95551 1/20 0.42
POLB P06746 1/20 0.42
MAPT P10636 1/20 0.42
IDO1 P14902 1/20 0.42
TDO2 P48775 1/20 0.42
BLM P54132 1/20 0.42
CASP6 P55212 1/20 0.42
KMT2A Q03164 1/20 0.42

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
SCHEMBL28788244 0.87 ALDH1A1 (0.46) ALDH1A1CYP3A4TDP1HPGDTSHR
SCHEMBL5658223 0.82 L3MBTL1 (0.45) ALDH1A1CYP3A4TDP1HPGDTSHR
SCHEMBL28279066 0.79 KDM4E (0.46) ALDH1A1CYP3A4TDP1HPGDTSHR
SCHEMBL29508482 0.74 ALDH1A1 (0.59) ALDH1A1CYP3A4TDP1HPGDTSHR
SCHEMBL20558075 0.74 GRM4 (0.49) ALDH1A1CYP3A4TDP1TSHRKDM4E
SCHEMBL14931471 0.74 ALDH1A1 (0.59) ALDH1A1CYP3A4TDP1HPGDTSHR
SCHEMBL7820375 0.73 ALDH1A1 (0.42) ALDH1A1CYP3A4TDP1HPGDTSHR
Hydrochloric Acid SCHEMBL28196297 0.72 CYP3A4 (0.56) ALDH1A1CYP3A4TDP1HPGDTSHR
SCHEMBL2380637 0.71 CYP3A4 (0.54) ALDH1A1CYP3A4TDP1HPGDTSHR
SCHEMBL31339851 0.71 CYP3A4 (0.54) ALDH1A1CYP3A4TDP1HPGDTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102316869-A The treatment method for cancer AMC AMSTERDAM 2012-01-11 CN claimed
CN-105384827-A Chimeric endonucleases and uses thereof BASF PLANT SCIENCE CO GMBH 2016-03-09 CN disclosed
CN-102686726-B Chimeric endonucleases and uses thereof BASF PLANT SCIENCE Co.,GmbH (DE) 2015-12-16 CN disclosed
CN-102388307-B Diagnosis of multiple sclerosis YEDA RES & DEV 2014-09-03 CN disclosed
CN-101137752-B Intron sequence for enhancing expression BASF PLANT SCIENCE GMBH 2013-04-03 CN disclosed
CN-102925479-A Expression enhancing intron sequences BASF PLANT SCIENCE GMBH 2013-02-13 CN disclosed
CN-102762726-A Chimeric endonucleases and uses thereof BASF PLANT SCIENCE CO GMBH 2012-10-31 CN disclosed
CN-102725412-A Optimized endonucleases and uses thereof BASF PLANT SCIENCE CO GMBH 2012-10-10 CN disclosed
CN-102686726-A Chimeric endonucleases and uses thereof BASF PLANT SCIENCE CO GMBH 2012-09-19 CN disclosed
CN-102388307-A Diagnosis of multiple sclerosis YEDA RES & DEV 2012-03-21 CN disclosed
CN-102316869-A The treatment method for cancer AMC AMSTERDAM 2012-01-11 CN disclosed
CN-101678002-A Methods of treatment using intravenous formulations comprising temozolomide SCHERING CORP 2010-03-24 CN disclosed
CN-100451123-C Recombination systems and a method for removing nucleic acid sequences from the genome of eukaryotic organisms SUNGENE GMBH & CO KGAA (DE) 2009-01-14 CN disclosed
CN-101137752-A Intron sequence for enhancing expression BASF PLANT SCIENCE GMBH (DE) 2008-03-05 CN disclosed
CN-100364438-C Use of astaxanthin-containing plants or parts of plants of the genus tagetes as animal feed SUNGENE GMBH & CO KGAA (DE) 2008-01-30 CN disclosed
CN-101098696-A Improved dosing regimen of temozolomide for treating cancer based on the patient's mgmt level SCHERING CORP (US) 2008-01-02 CN disclosed
CN-1688712-A Method for producing ketocarotenoids in flowers of plants SUNGENE GMBH & CO KGAA (DE) 2005-10-26 CN disclosed
CN-1688206-A Use of astaxanthin-containing plants or parts of plants of the genus tagetes as animal feed SUNGENE GMBH & CO KGAA (DE) 2005-10-26 CN disclosed
CN-1628174-A Recombination systems and a method for removing nucleic acid sequences from the genome of eukaryotic organisms SUNGENE GMBH & CO KGAA (DE) 2005-06-15 CN disclosed