SCHEMBL2153297

SCHEMBL2153297

CCCCCc1c(O)n2c(nc3ccccc32)[nH]c1=O

nearest known ligand 0.93

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.93
RPA1 P27694 1/20 0.75
MEN1 O00255 1/20 0.69
KMT2A Q03164 1/20 0.69
RAB9A P51151 3/20 0.63
NPC1 O15118 1/20 0.63
ALDH1A1 P00352 6/20 0.54
KDM4E B2RXH2 6/20 0.54
HPGD P15428 5/20 0.54
HSD17B10 Q99714 4/20 0.53
MAPK10 P53779 1/20 0.53
GAA P10253 1/20 0.47
TLR7 Q9NYK1 2/20 0.46
LMNA P02545 2/20 0.46
MAPT P10636 1/20 0.44
XBP1 P17861 1/20 0.44
HTT P42858 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
ADORA1 P30542 1/20 0.43
ADORA2A P29274 1/20 0.42

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
SCHEMBL23335527 0.81 RAB9A (0.78) SMN1; SMN2RPA1MEN1KMT2ARAB9A
SCHEMBL2153291 0.78 SMN1; SMN2 (0.59) SMN1; SMN2RPA1MEN1KMT2ARAB9A
SCHEMBL23335650 0.78 RAB9A (1.00) SMN1; SMN2RPA1MEN1KMT2ARAB9A
SCHEMBL23335648 0.73 RAB9A (0.88) SMN1; SMN2RPA1MEN1KMT2ARAB9A
SCHEMBL23335770 0.72 KDM4E (0.74) SMN1; SMN2RPA1MEN1KMT2ARAB9A
SCHEMBL23335549 0.71 RAB9A (0.67) SMN1; SMN2RPA1MEN1KMT2ARAB9A
SCHEMBL11699629 0.71 MEN1 (0.56) SMN1; SMN2RPA1MEN1KMT2ARAB9A
SCHEMBL23335651 0.70 KDM4E (1.00) SMN1; SMN2RPA1MEN1KMT2ARAB9A
SCHEMBL23335555 0.70 KDM4E (0.70) SMN1; SMN2RPA1MEN1KMT2ARAB9A
SCHEMBL23335541 0.70 RAB9A (0.77) SMN1; SMN2RPA1MEN1KMT2ARAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7981207-B2 Dye compound and ink containing dye compound CANON KABUSHIKI KAISHA (JP) 2011-07-19 US disclosed
US-20090293765-A1 DYE COMPOUND AND INK CONTAINING DYE COMPOUND CANON KABUSHIKI KAISHA (JP) 2009-12-03 US disclosed