SCHEMBL6947065

SCHEMBL6947065

Cc1ccsc1Cc1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRA1D P25100 2/20 0.46
CALM1 P0DP23 1/20 0.44
ALOX5 P09917 1/20 0.40
ALDH1A1 P00352 5/20 0.39
MAPT P10636 3/20 0.39
USP2 O75604 1/20 0.39
HPGD P15428 1/20 0.39
ALOX15 P16050 1/20 0.39
RECQL P46063 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
HSD17B10 Q99714 1/20 0.39
KDM4E B2RXH2 2/20 0.38
MAOA P21397 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.37
PTPN1 P18031 1/20 0.37
MEN1 O00255 1/20 0.36
LMNA P02545 1/20 0.36
POLB P06746 1/20 0.36
GAA P10253 1/20 0.36
KMT2A Q03164 1/20 0.36

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
SCHEMBL8306828 0.80 ALDH1A1 (0.47) ADRA1DALOX5ALDH1A1MAPTHPGD
SCHEMBL12425696 0.78 TAAR1 (0.45) ADRA1DALDH1A1
SCHEMBL371748 0.77 CALM1 (0.46) CALM1ALOX5HPGDALOX15HSD17B10
SCHEMBL9024878 0.75 CALM1 (0.44) CALM1ALOX5ALDH1A1MAPTUSP2
SCHEMBL28408319 0.75 SLC6A2 (0.39) CALM1ALDH1A1MAPTUSP2HPGD
SCHEMBL15055602 0.75 KEAP1 (0.56) ADRA1DCALM1ALDH1A1MAPTUSP2
SCHEMBL6346971 0.73 ADRA1D (0.45) ADRA1DALOX5ALDH1A1HPGDLMNA
SCHEMBL22624586 0.73 ADRA1D (0.45) ADRA1DCALM1ALDH1A1MAPTUSP2
Ethylamine SCHEMBL10586929 0.73 ADRA1D (0.39) ADRA1DALOX5ALDH1A1HPGDRECQL
Ethylamine SCHEMBL10588624 0.72 RAPGEF4 (0.36) ADRA1DALOX5ALDH1A1MAPTALOX15

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
EP-1218739-A4 2-AMINOPYRIDINE DERIVATIVES AND COMBINATORIAL LIBRARIES THEREOF LION BIOSCIENCE AG (DE) 2003-06-04 EP claimed
US-6458789-B1 ANTICOAGULENTS, ANTIHISTAMINES, ANTISEPTICS, ANTIARRHYTHMICS AND ANTIRHEUMATICS LION BIOSCIENCE AG (DE) 2002-10-01 US claimed
EP-1218739-A1 2-AMINOPYRIDINE DERIVATIVES AND COMBINATORIAL LIBRARIES THEREOF TREGA BIOSCIENCES, INC. (US) 2002-07-03 EP claimed
WO-2001023887-A1 2-AMINOPYRIDINE DERIVATIVES AND COMBINATORIAL LIBRARIES THEREOF LION BIOSCIENCE AG (DE) 2001-04-05 WO claimed
CN-110403005-A The food materials anti-metamorphic protection liquid and its preparation method of herbal medicine fruits and vegetables QUANRAN YINCHUAN TECH CO LTD 2019-11-05 CN disclosed
CN-110261555-A The herb medicines such as Radix Astragali semen coicis matter data information detector and method 权冉(银川)科技有限公司 2019-09-20 CN disclosed
CN-109781668-A Sensor material and data informatization detection for quality of medicinal materials, fruits and vegetables 权冉(银川)科技有限公司 2019-05-21 CN disclosed
CN-109781719-A A kind of kit detecting trypsase and its inhibitor based on platinum cluster 福建医科大学 2019-05-21 CN disclosed
CN-109164099-A A method of detection indoor formaldehyde content 张垚 2019-01-08 CN disclosed
CN-108395423-A The synthetic method of 2- benzal tetrahydrothiophene derivatives 苏州大学张家港工业技术研究院 2018-08-14 CN disclosed
CN-102977036-B 2-(poly-substituted aryl)-6-amino-5-halo-4-pyrimidinecarboxylic acids and their use as herbicides 美国陶氏益农公司 2017-05-03 CN disclosed
CN-102731381-B The polysubstituted aryl of 6-()-4-aminopyridine formic acid esters and the purposes as herbicide thereof 美国陶氏益农公司 2016-08-17 CN disclosed
CN-102271516-A Stable insecticide compositions and methods for producing same 2011-12-07 CN disclosed
CN-101478877-A Method for controlling insects resistant to common insecticides DOW AGROSCIENCES LLC (US) 2009-07-08 CN disclosed
CN-101384552-A Insecticidal N-substituted (6-haloalkylpyridin-3-yl) alkylsulfinimides DOW AGROSCIENCES LLC (US) 2009-03-11 CN disclosed
EP-1218739-A4 2-AMINOPYRIDINE DERIVATIVES AND COMBINATORIAL LIBRARIES THEREOF LION BIOSCIENCE AG (DE) 2003-06-04 EP disclosed
US-6458789-B1 ANTICOAGULENTS, ANTIHISTAMINES, ANTISEPTICS, ANTIARRHYTHMICS AND ANTIRHEUMATICS LION BIOSCIENCE AG (DE) 2002-10-01 US disclosed
EP-1218739-A1 2-AMINOPYRIDINE DERIVATIVES AND COMBINATORIAL LIBRARIES THEREOF TREGA BIOSCIENCES, INC. (US) 2002-07-03 EP disclosed
WO-2001023887-A1 2-AMINOPYRIDINE DERIVATIVES AND COMBINATORIAL LIBRARIES THEREOF LION BIOSCIENCE AG (DE) 2001-04-05 WO disclosed