SCHEMBL16601703

SCHEMBL16601703

O=[N+]([O-])c1ccc2c(c1)C(=Nc1cccc(O)c1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1-2

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSP90AA1 P07900 2/20 0.76
HPRT1 P00492 1/20 0.48
ALDH1A1 P00352 3/20 0.44
TSHR P16473 2/20 0.44
ALOX15 P16050 1/20 0.44
MAPT P10636 4/20 0.43
KMT2A Q03164 4/20 0.42
MEN1 O00255 3/20 0.42
PKM P14618 2/20 0.42
MPI P34949 1/20 0.42
GALK1 P51570 1/20 0.42
SAE1 Q9UBE0 1/20 0.42
UBA2 Q9UBT2 1/20 0.42
KDM4E B2RXH2 1/20 0.41
MCL1 Q07820 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.40
GPR35 Q9HC97 2/20 0.40
TP53 P04637 1/20 0.40
HPGD P15428 1/20 0.40
MAPK1 P28482 1/20 0.40

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
SCHEMBL11694193 0.90 HSP90AA1 (0.82) HSP90AA1HPRT1ALDH1A1TSHRMAPT
SCHEMBL11694187 0.90 HSP90AA1 (0.82) HSP90AA1HPRT1ALDH1A1TSHRMAPT
SCHEMBL16656204 0.87 HSP90AA1 (0.66) HSP90AA1HPRT1ALDH1A1TSHRALOX15
SCHEMBL11694409 0.87 HSP90AA1 (0.76) HSP90AA1HPRT1ALDH1A1MAPTKMT2A
SCHEMBL11694416 0.87 HSP90AA1 (0.76) HSP90AA1HPRT1ALDH1A1MAPTKMT2A
SCHEMBL14922778 0.86 HSP90AA1 (1.00) HSP90AA1HPRT1ALDH1A1TSHRMAPT
SCHEMBL11781806 0.86 HSP90AA1 (0.76) HSP90AA1HPRT1ALDH1A1MAPTKMT2A
SCHEMBL11781812 0.86 HSP90AA1 (0.76) HSP90AA1HPRT1ALDH1A1MAPTKMT2A
SCHEMBL11781032 0.84 HSP90AA1 (0.72) HSP90AA1HPRT1ALDH1A1TSHRMAPT
SCHEMBL11781023 0.84 HSP90AA1 (0.72) HSP90AA1HPRT1ALDH1A1TSHRMAPT

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 4 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-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