SCHEMBL855604

SCHEMBL855604

C=CN(CCCC)Cc1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 4/20 0.44
TSHR P16473 2/20 0.41
ALDH1A1 P00352 1/20 0.41
NR1H2 P55055 1/20 0.40
NR1H3 Q13133 1/20 0.40
KMT2A Q03164 2/20 0.40
MEN1 O00255 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
BCHE P06276 1/20 0.40
MAPT P10636 1/20 0.40
SIGMAR1 Q99720 1/20 0.40
GAA P10253 1/20 0.39
CNR2 P34972 1/20 0.39

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
SCHEMBL9500849 0.96 KCNH2 (0.47) KCNH2TSHRALDH1A1BCHESIGMAR1
SCHEMBL27527563 0.95 KCNH2 (0.50) KCNH2KMT2AMEN1BCHESIGMAR1
SCHEMBL9602480 0.95 KCNH2 (0.50) KCNH2KMT2AMEN1BCHESIGMAR1
Hydrochloric Acid SCHEMBL27850433 0.93 KCNH2 (0.49) KCNH2BCHESIGMAR1CNR2
Hydrochloric Acid SCHEMBL27850434 0.93 KCNH2 (0.49) KCNH2BCHESIGMAR1CNR2
SCHEMBL26619205 0.88 EPHX2 (0.46) KCNH2CNR2
SCHEMBL7272839 0.82 HDAC6 (0.44) KCNH2TSHRALDH1A1NR1H2NR1H3
SCHEMBL989475 0.81 KCNH2 (0.64) KCNH2BCHESIGMAR1
SCHEMBL6658937 0.81 KCNH2 (0.55) KCNH2SIGMAR1
SCHEMBL988252 0.81 KCNH2 (0.55) KCNH2SIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2559740-B1 BINDER FOR INKJET PRINTING INK AND INKJET PRINTING INK AND PRINTED MATTER CONTAINING SAME DAINIPPON INK & CHEMICALS (JP) 2019-07-24 EP disclosed
EP-3020772-B1 AQUEOUS COATING AGENT AND ARTICLE USING SAME DAINIPPON INK & CHEMICALS (JP) 2019-06-12 EP disclosed
CN-104073111-B Smears, metal conditioner and article DIC株式会社 2017-11-21 CN disclosed
US-9803087-B2 Aqueous coating agent and article using same DIC CORPORATION (JP) 2017-10-31 US disclosed
CN-105378007-B Aqueous coating agent and article using same DIC株式会社 2017-06-06 CN disclosed
US-20160369106-A1 AQUEOUS COATING AGENT AND ARTICLE USING SAME DIC CORPORATION (JP) 2016-12-22 US disclosed
EP-3020772-A1 AQUEOUS COATING AGENT AND ARTICLE USING SAME DIC Corporation (JP) 2016-05-18 EP disclosed
CN-105378007-A Aqueous coating agent and article using same DAINIPPON INK & CHEMICALS 2016-03-02 CN disclosed
CN-102884144-B Ink jet printing ink liquid binding agent, ink jet printing black liquid and print containing this binding agent DIC CORP. (JP) 2015-08-19 CN disclosed
CN-104073111-A Coating agent, metal surface treatment agent and article DAINIPPON INK & CHEMICALS 2014-10-01 CN disclosed
CN-102884144-A Binder for inkjet printing ink and inkjet printing ink and printed matter containing same DAINIPPON INK & CHEMICALS 2013-01-16 CN disclosed
CN-101796149-B Coating agent and method for production thereof DAINIPPON INK & CHEMICALS 2012-10-10 CN disclosed
EP-2221352-B1 COATING AGENT AND METHOD FOR PRODUCTION THEREOF DAINIPPON INK & CHEMICALS (JP) 2012-03-28 EP disclosed
US-8045846-B2 Composition for heat-storage object formation, heat-storage object, and process for producing heat-storage object SK KAKEN CO., LTD. (JP) 2011-10-25 US disclosed
US-20100273930-A1 COATING AGENT AND METHOD FOR PRODUCTION THEREOF DIC CORPORATION (JP) 2010-10-28 US disclosed
EP-2221352-A1 COATING AGENT AND METHOD FOR PRODUCTION THEREOF DIC Corporation (JP) 2010-08-25 EP disclosed
CN-101796149-A Coating agent and method for production thereof DAINIPPON INK & CHEMICALS 2010-08-04 CN disclosed
US-20090199994-A1 COMPOSITION FOR HEAT-STORAGE OBJECT FORMATION, HEAT-STORAGE OBJECT, AND PROCESS FOR PRODUCING HEAT-STORAGE OBJECT SK KAKEN CO., LTD (JP) 2009-08-13 US disclosed
CN-101107340-A Composition for heat-storage object formation, heat-storage object, and process for producing heat-storage object SK KAKEN CO LTD (JP) 2008-01-16 CN disclosed
EP-1857520-A1 COMPOSITION FOR HEAT-STORAGE OBJECT FORMATION, HEAT-STORAGE OBJECT, AND PROCESS FOR PRODUCING HEAT-STORAGE OBJECT SK Kaken Co., Ltd. (JP) 2007-11-21 EP disclosed