SCHEMBL16601788

SCHEMBL16601788

O=C1C=C(c2cccc(CO)c2)C(=O)c2ccccc21

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 5/20 0.60
PTPN1 P18031 4/20 0.44
PTPRC P08575 3/20 0.44
CDC25B P30305 2/20 0.44
PTPRF P10586 1/20 0.44
DHODH Q02127 1/20 0.42
PRKCI P41743 1/20 0.41
S100A4 P26447 1/20 0.41
CNR2 P34972 1/20 0.40
ACMSD Q8TDX5 1/20 0.39
CHEK1 O14757 1/20 0.39
CHRNB4 P30926 1/20 0.39
CHRNA3 P32297 1/20 0.39
CHRNA7 P36544 1/20 0.39
MEN1 O00255 1/20 0.39
PLIN1 O60240 1/20 0.39
NR1I2 O75469 1/20 0.39
USP2 O75604 1/20 0.39
ALDH1A1 P00352 1/20 0.39
GSR P00390 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
SCHEMBL28246092 0.85 BACE1 (0.60) BACE1PTPN1PTPRCCDC25BPTPRF
SCHEMBL15764225 0.83 BACE1 (0.68) BACE1PTPN1PTPRCCDC25BPTPRF
SCHEMBL24849449 0.80 BACE1 (0.68) BACE1PTPN1PTPRCCDC25BPTPRF
SCHEMBL16601796 0.76 BACE1 (0.66) BACE1PTPN1PTPRCCDC25BPTPRF
SCHEMBL5485068 0.76 BACE1 (1.00) BACE1PTPN1PTPRCCDC25BPTPRF
SCHEMBL29673492 0.76 BACE1 (1.00) BACE1PTPN1PTPRCCDC25BPTPRF
SCHEMBL16601979 0.76 BACE1 (0.65) BACE1PTPN1PTPRCCDC25BPTPRF
SCHEMBL15764211 0.75 NPC1 (0.64) PTPN1PTPRCDHODHPRKCIS100A4
SCHEMBL28865245 0.73 BACE1 (0.66) BACE1PTPN1PTPRCCDC25BPTPRF
SCHEMBL16601767 0.73 DHODH (0.42) CDC25BDHODHPRKCIS100A4CNR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2680079-B1 Electrophotographic photosensitive member, process catridge, and electrophotographic apparatus CANON KK (JP) 2016-05-04 EP disclosed
US-8993205-B2 Electrophotographic photosensitive member, process cartridge, and electrophotographic apparatus CANON KABUSHIKI KAISHA (JP) 2015-03-31 US disclosed
US-8993205-B2 Electrophotographic photosensitive member, process cartridge, and electrophotographic apparatus CANON KABUSHIKI KAISHA (JP) 2015-03-31 US disclosed