SCHEMBL624673

SCHEMBL624673

CCCCCC1CCCN1C#N

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
S1PR1 P21453 3/20 0.42
S1PR3 Q99500 3/20 0.42
S1PR5 Q9H228 3/20 0.42
CTSL P07711 2/20 0.40
CTSK P43235 2/20 0.40
CHRNB2 P17787 1/20 0.39
CHRNA7 P36544 1/20 0.39
CHRNA4 P43681 1/20 0.39
LSS P48449 2/20 0.38
CTSB P07858 1/20 0.38
S1PR4 O95977 1/20 0.37
DPP4 P27487 4/20 0.35
SPHK2 Q9NRA0 2/20 0.33
SPHK1 Q9NYA1 2/20 0.33
BCHE P06276 2/20 0.33

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
SCHEMBL6512644 0.82 S1PR1 (0.46) S1PR1S1PR3S1PR5CHRNB2CHRNA7
SCHEMBL11644631 0.81 ALDH1A1 (0.34) S1PR1S1PR3S1PR5CHRNB2CHRNA7
SCHEMBL5696209 0.81 SIGMAR1 (0.40) S1PR1S1PR3S1PR5CTSLCTSK
SCHEMBL6507955 0.76 S1PR1 (0.40) S1PR1S1PR3S1PR5CHRNB2CHRNA7
SCHEMBL4554930 0.75 CTSL (0.38) S1PR1S1PR3S1PR5CTSLCTSK
SCHEMBL11647013 0.75
SCHEMBL13183150 0.73 CTSL (0.38) CTSLCTSKCTSB
SCHEMBL292866 0.73 S1PR1 (0.54) S1PR1S1PR3S1PR5CHRNB2CHRNA7
SCHEMBL15481483 0.72 S1PR1 (0.45) S1PR1S1PR3S1PR5CHRNB2CHRNA7
SCHEMBL292865 0.72 S1PR1 (0.45) S1PR1S1PR3S1PR5CHRNB2CHRNA7

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 33 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109627088-A A kind of Intelligent controlled release medicine fat particles agent of nitrile compounds containing aryl-pyrrolidine and pyridine insecticides 河南好年景生物发展有限公司 2019-04-16 CN claimed
CN-105622598-B Aryl-pyrrolidine nitrile compounds and preparation method and purposes and agricultural insecticide and pest control method for desinsection 河南好年景生物发展有限公司 2017-12-22 CN claimed
CN-105622598-A Arylpyrrole nitrile compound used for killing insects, preparation method and application thereof, agricultural insecticide and pest prevention method HENAN HAONIANJING BIOLOGY DEV CO LTD 2016-06-01 CN claimed
CN-1501796-A Treatment of type 2 diabetes mellitus using inhibitors of dipeptidyl peptidase IV ���ֹɷݹ�˾ 2004-06-02 CN claimed
CN-109627088-A A kind of Intelligent controlled release medicine fat particles agent of nitrile compounds containing aryl-pyrrolidine and pyridine insecticides 河南好年景生物发展有限公司 2019-04-16 CN disclosed
CN-109627088-A A kind of Intelligent controlled release medicine fat particles agent of nitrile compounds containing aryl-pyrrolidine and pyridine insecticides 河南好年景生物发展有限公司 2019-04-16 CN disclosed
CN-109369498-A A kind of method that microreactor continuously synthesizes the bromo- 2- rubigan -5- trifluoromethyl pyrpole -3- nitrile of 4- 湖南海利常德农药化工有限公司 2019-02-22 CN disclosed
CN-109169668-A 2- aryl substituted pyrroles class compound is killing the application in vesicle spiral shell drug 江苏省血吸虫病防治研究所 2019-01-11 CN disclosed
CN-109006823-A Application of the 2- aryl substituted pyrroles class compound in snail-killing medicine 江苏省血吸虫病防治研究所 2018-12-18 CN disclosed
CN-109006824-A 2- aryl substituted pyrroles class compound is killing the application in double navel spiral shell drugs 江苏省血吸虫病防治研究所 2018-12-18 CN disclosed
CN-106083628-B A kind of method for preparing p-chlorophenylglycine 河北大学 2018-06-26 CN disclosed
CN-105622598-B Aryl-pyrrolidine nitrile compounds and preparation method and purposes and agricultural insecticide and pest control method for desinsection 河南好年景生物发展有限公司 2017-12-22 CN disclosed
CN-1439634-A Preparation of 2-aryl-5-(trifluoride) pyrrole-3-nitrile and its use and preparation of its intermediate thereof JIANGSU PESTICIDE INST CO LTD (CN) 2003-09-03 CN disclosed
CN-1066442-C Manufacture of 4-aryl 1-2-perfluoroalkyl-3-oxazolin-5-one from arylglycine AMERICAN CYANAMID CO (US) 2001-05-30 CN disclosed
CN-1053661-C Method for the preparation of 2-perflouoroalkyl-3-oxazolin-5-one AMERICAN CYANAMID CO (US) 2000-06-21 CN disclosed
CN-1170721-A Ammonium oxazole and amino oxazolium intermediates, methods for preparation thereof and use therefor in manufacture of insecticidal arylpyrroles AMERICAN CYANAMID CO (US) 1998-01-21 CN disclosed
CN-1170718-A Process for manufacture of 2-aryl-5-perfluoroalkylpyrrole derivatives and intermediates useful therefor AMERICAN CYANAMID CO (US) 1998-01-21 CN disclosed
CN-1133836-A Process for manufacture of insecticidal arylpyrrolwa via oxazole amine intermediates AMERICAN CYANAMID CO (US) 1996-10-23 CN disclosed
CN-1132749-A Manufacture of 4-aryl 1-2-perfluoroalkyl-3-oxazolin-5-one from arylglycine AMERICAN CYANAMID CO (US) 1996-10-09 CN disclosed
CN-1107148-A Method for the preparation of 2-perflouoroalkyl-3-oxazolin-5-one AMERICAN CYANAMID CO (US) 1995-08-23 CN disclosed