SCHEMBL6380267

SCHEMBL6380267

N#Cc1cc(-c2ccc3c(c2)OCO3)[nH]c1N

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 5/20 0.49
ALDH1A1 P00352 5/20 0.49
KDM4E B2RXH2 4/20 0.49
HPGD P15428 4/20 0.49
GAA P10253 3/20 0.49
LMNA P02545 2/20 0.49
NPSR1 Q6W5P4 2/20 0.49
ALOX15 P16050 4/20 0.49
MAPT P10636 3/20 0.49
MEN1 O00255 3/20 0.49
KMT2A Q03164 3/20 0.49
POLB P06746 2/20 0.49
ALOX12 P18054 2/20 0.49
HTT P42858 1/20 0.48
ADORA1 P30542 8/20 0.45
ADORA2A P29274 6/20 0.45
ADORA2B P29275 2/20 0.45
PDE10A Q9Y233 1/20 0.45
USP2 O75604 2/20 0.44
TSHR P16473 2/20 0.44

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
SCHEMBL6381145 0.78 TBK1 (0.50) HSD17B10ALDH1A1KDM4EHPGDGAA
SCHEMBL9526335 0.77 KDM4E (0.51) HSD17B10ALDH1A1KDM4EHPGDGAA
SCHEMBL1825884 0.73 PARP1 (0.53) HSD17B10ALDH1A1KDM4EHPGDMAPT
SCHEMBL28946476 0.73 GSK3B (0.59) HSD17B10ALDH1A1KDM4EHPGDGAA
SCHEMBL15661524 0.71 PDE10A (0.42) HSD17B10ALDH1A1KDM4EHPGDGAA
SCHEMBL2202173 0.69 BCL2L1 (0.54) HSD17B10ALDH1A1KDM4EHPGDGAA
SCHEMBL6445055 0.69 ADORA1 (0.60) HSD17B10ALDH1A1KDM4EHPGDGAA
SCHEMBL6960194 0.67 SNCA (0.56) ALDH1A1MAPTMEN1KMT2AADORA1
SCHEMBL30132131 0.67 ALDH1A1 (0.58) HSD17B10ALDH1A1KDM4EHPGDGAA
SCHEMBL11820723 0.66 PDE10A (0.66) ALDH1A1KDM4EHPGDLMNAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1057485-B1 POTASSIUM CHANNEL ACTIVATORS NIPPON SHINYAKU CO LTD (JP) 2005-05-11 EP claimed
US-6353016-B1 PYRROLE COMPOUNDS FOR POTASSIUM CHANNEL ACTIVATORS NIPPON SHINYAKU CO., LTD. (JP) 2002-03-05 US claimed
EP-1057485-A1 POTASSIUM CHANNEL ACTIVATORS Nippon Shinyaku Co., Ltd. (JP) 2000-12-06 EP claimed
EP-1057485-B1 POTASSIUM CHANNEL ACTIVATORS NIPPON SHINYAKU CO LTD (JP) 2005-05-11 EP disclosed
US-6353016-B1 PYRROLE COMPOUNDS FOR POTASSIUM CHANNEL ACTIVATORS NIPPON SHINYAKU CO., LTD. (JP) 2002-03-05 US disclosed
EP-1057485-A1 POTASSIUM CHANNEL ACTIVATORS Nippon Shinyaku Co., Ltd. (JP) 2000-12-06 EP disclosed