SCHEMBL16601699

SCHEMBL16601699

O=[N+]([O-])c1cccc2c1-c1ccccc1C2=Nc1ccc(CO)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
S100A4 P26447 2/20 0.48
PTPRC P08575 1/20 0.48
SMN1; SMN2 Q16637 3/20 0.44
KMT2A Q03164 5/20 0.42
MEN1 O00255 3/20 0.42
MAPT P10636 4/20 0.41
THRB P10828 1/20 0.41
HPGD P15428 1/20 0.41
MAPK1 P28482 1/20 0.41
ALDH1A1 P00352 4/20 0.40
HSP90AA1 P07900 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA7 P43166 1/20 0.39
CA9 Q16790 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
GPR35 Q9HC97 1/20 0.38
POLB P06746 1/20 0.38
PKM P14618 1/20 0.38
MPI P34949 1/20 0.38

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
SCHEMBL16601755 0.77 ALDH1A1 (0.68) SMN1; SMN2KMT2AMEN1MAPTALDH1A1
SCHEMBL16656351 0.76 MAPT (0.47) SMN1; SMN2KMT2AMEN1MAPTALDH1A1
SCHEMBL16601726 0.76 MAPT (0.47) SMN1; SMN2KMT2AMEN1MAPTALDH1A1
SCHEMBL12111804 0.76 HSP90AA1 (0.54) S100A4PTPRCSMN1; SMN2KMT2AMEN1
SCHEMBL14922784 0.75 HSP90AA1 (0.65) S100A4PTPRCSMN1; SMN2KMT2AMEN1
SCHEMBL16601744 0.75 ALDH1A1 (0.43) KMT2AMEN1MAPTTHRBALDH1A1
SCHEMBL11781236 0.74 HSP90AA1 (0.64) S100A4PTPRCSMN1; SMN2KMT2AMEN1
SCHEMBL11781232 0.74 HSP90AA1 (0.64) S100A4PTPRCSMN1; SMN2KMT2AMEN1
SCHEMBL16601743 0.74 MEN1 (0.49) KMT2AMEN1ALDH1A1LRRK2
SCHEMBL7785924 0.73 ALDH1A1 (0.67) S100A4PTPRCSMN1; SMN2KMT2AMEN1

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
US-9012112-B2 Electrophotographic photosensitive member, process cartridge, and electrophotographic apparatus CANON KABUSHIKI KAISHA (JP) 2015-04-21 US 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