SCHEMBL16656351

SCHEMBL16656351

O=[N+]([O-])c1ccc(N=C2c3ccccc3-c3c2cccc3-c2cccc(CO)c2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.47
ALDH1A1 P00352 3/20 0.47
PKM P14618 1/20 0.47
MPI P34949 1/20 0.47
GALK1 P51570 1/20 0.47
SAE1 Q9UBE0 1/20 0.47
UBA2 Q9UBT2 1/20 0.47
TTR P02766 3/20 0.43
LRRK2 Q5S007 1/20 0.43
HSP90AA1 P07900 2/20 0.39
CDK5 Q00535 1/20 0.39
CDK5R1 Q15078 1/20 0.39
NCOA1 Q15788 1/20 0.39
NCOA3 Q9Y6Q9 1/20 0.39
AR P10275 2/20 0.36
KMT2A Q03164 3/20 0.36
MDM2 Q00987 1/20 0.35
POLB P06746 2/20 0.35
RAB9A P51151 1/20 0.35
PTGDR2 Q9Y5Y4 1/20 0.35

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
SCHEMBL16601726 1.00 MAPT (0.47) MAPTALDH1A1PKMMPIGALK1
SCHEMBL16601752 0.80 FYN (0.42) ALDH1A1LRRK2KMT2ARAB9AMEN1
SCHEMBL16656346 0.80 FYN (0.42) ALDH1A1LRRK2KMT2ARAB9AMEN1
SCHEMBL16656340 0.78 MAPT (0.41) MAPTNCOA1NCOA3KMT2ARAB9A
SCHEMBL16601753 0.78 MAPT (0.41) MAPTNCOA1NCOA3KMT2ARAB9A
SCHEMBL16601699 0.76 S100A4 (0.48) MAPTALDH1A1PKMMPIGALK1
SCHEMBL14922777 0.74 KMT2A (0.51) MAPTALDH1A1HSP90AA1KMT2ARAB9A
SCHEMBL16601758 0.72 ALDH1A1 (0.46) ALDH1A1CNR2
SCHEMBL16601744 0.72 ALDH1A1 (0.43) MAPTALDH1A1PKMKMT2AMEN1
SCHEMBL10586625 0.71 ALDH1A1 (0.64) MAPTALDH1A1KMT2ARAB9ACNR2

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-2680077-B1 Electrophotographic photosensitive member, process catridge, and electrophotographic apparatus CANON KK (JP) 2015-10-28 EP disclosed
US-9012112-B2 Electrophotographic photosensitive member, process cartridge, and electrophotographic apparatus CANON KABUSHIKI KAISHA (JP) 2015-04-21 US disclosed