SCHEMBL16601979

SCHEMBL16601979

O=C(O)c1cccc(C2=CC(=O)c3ccccc3C2=O)c1

nearest known ligand 0.65

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 4/20 0.65
MAP2K7 O14733 1/20 0.57
KMO O15229 1/20 0.53
CDC25B P30305 2/20 0.50
TTR P02766 1/20 0.50
PTPN1 P18031 4/20 0.49
PTPRC P08575 3/20 0.49
PTPRF P10586 1/20 0.47
TDP2 O95551 1/20 0.47
G6PD P11413 1/20 0.47
PAX8 Q06710 1/20 0.47
HKDC1 Q2TB90 1/20 0.47
HDAC6 Q9UBN7 1/20 0.47
NR1H4 Q96RI1 1/20 0.45

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
SCHEMBL29673492 0.80 BACE1 (1.00) BACE1CDC25BPTPN1PTPRCPTPRF
SCHEMBL5485068 0.80 BACE1 (1.00) BACE1CDC25BPTPN1PTPRCPTPRF
SCHEMBL24849449 0.80 BACE1 (0.68) BACE1CDC25BPTPN1PTPRCPTPRF
SCHEMBL27734065 0.78 BACE1 (0.69) BACE1CDC25BPTPN1PTPRCPTPRF
SCHEMBL16601796 0.76 BACE1 (0.66) BACE1CDC25BPTPN1PTPRCPTPRF
SCHEMBL30259065 0.76 KMO (0.73) KMONR1H4
SCHEMBL2213546 0.76 KMO (0.73) KMONR1H4
SCHEMBL16602021 0.76 KMO (0.49) BACE1KMOTTR
SCHEMBL16601788 0.76 BACE1 (0.60) BACE1CDC25BPTPN1PTPRCPTPRF
Methylamine SCHEMBL3277347 0.75 BACE1 (0.89) BACE1CDC25BPTPN1PTPRCPTPRF

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
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