SCHEMBL13822698

SCHEMBL13822698

C=C[n+]1ccn(C)c1-c1ccccc1

nearest known ligand 0.33

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
ALDH1A1 P00352 1/20 0.33
LMNA P02545 1/20 0.33
PCSK9 Q8NBP7 1/20 0.33
KMT2A Q03164 2/20 0.32
SLC22A2 O15244 1/20 0.32
SLC22A1 O15245 1/20 0.32
SLC22A3 O75751 1/20 0.32
SLC6A4 P31645 1/20 0.32
BRD4 O60885 1/20 0.32
NPC1 O15118 1/20 0.30
RAB9A P51151 1/20 0.30
NR1H2 P55055 1/20 0.30
NR1H3 Q13133 1/20 0.30

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
SCHEMBL1830961 0.73 NPSR1 (0.47) NPSR1L3MBTL1LMNAPCSK9KMT2A
SCHEMBL5290699 0.70 SLC22A2 (0.34) NPSR1L3MBTL1ALDH1A1PCSK9KMT2A
SCHEMBL5287380 0.69 KMT2A (0.33) NPSR1L3MBTL1PCSK9KMT2ASLC22A2
SCHEMBL13822423 0.69
Hydrochloric Acid SCHEMBL7622909 0.67 HDAC8 (0.32)
SCHEMBL13822699 0.64 SLC22A2 (0.36) NPSR1L3MBTL1LMNAKMT2ASLC22A2
SCHEMBL9809513 0.63 ALOX15 (0.33) ALDH1A1
Hydrochloric Acid SCHEMBL4035931 0.62 KDM4E (0.32) NPSR1ALDH1A1KMT2ASLC22A2SLC22A1
Hydrochloric Acid SCHEMBL4035925 0.60 KDM4E (0.32) NPSR1ALDH1A1KMT2ASLC22A2SLC22A1
Biphenyl SCHEMBL664141 0.59 ALDH1A1 (0.60) L3MBTL1ALDH1A1LMNASLC22A2SLC22A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9356318-B2 Gel polymer electrolyte composition KURARAY CO., LTD. (JP) 2016-05-31 US disclosed
EP-2524932-B1 GEL POLYMER ELECTROLYTE COMPOSITION KURARAY CO (JP) 2015-11-25 EP disclosed
US-20120321963-A1 GEL POLYMER ELECTROLYTE COMPOSITION KURARAY CO., LTD. (JP) 2012-12-20 US disclosed
EP-2524932-A1 GEL POLYMER ELECTROLYTE COMPOSITION Kuraray Co., Ltd. (JP) 2012-11-21 EP disclosed