SCHEMBL8028229

SCHEMBL8028229

CC(C(=O)C1=C(c2ccccc2)C(=O)c2ccccc2C1=O)[N+](=O)[O-]

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSP90AA1 P07900 5/20 0.59
HSP90AB1 P08238 3/20 0.59
NPSR1 Q6W5P4 4/20 0.54
LMNA P02545 4/20 0.54
ALDH1A1 P00352 4/20 0.54
MEN1 O00255 3/20 0.54
KMT2A Q03164 3/20 0.54
SMN1; SMN2 Q16637 3/20 0.54
XBP1 P17861 2/20 0.54
HKDC1 Q2TB90 2/20 0.54
L3MBTL1 Q9Y468 2/20 0.54
FGFR1 P11362 7/20 0.50
FGFR2 P21802 7/20 0.50
FGFR4 P22455 7/20 0.50
FGFR3 P22607 7/20 0.50
SRC P12931 5/20 0.48
CRHBP P24387 1/20 0.48
CRHR2 Q13324 1/20 0.48
MAPT P10636 4/20 0.47
TDP1 Q9NUW8 4/20 0.47

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
SCHEMBL17969803 0.82 HSP90AA1 (0.70) HSP90AA1HSP90AB1NPSR1LMNAALDH1A1
SCHEMBL17969802 0.75 HSP90AA1 (1.00) HSP90AA1HSP90AB1NPSR1LMNAALDH1A1
SCHEMBL13770821 0.74 FGFR1 (0.85) HSP90AA1HSP90AB1NPSR1LMNAALDH1A1
SCHEMBL8028224 0.73 HSP90AA1 (0.54) HSP90AA1HSP90AB1NPSR1LMNAALDH1A1
SCHEMBL8018163 0.72 LMNA (0.71) HSP90AA1HSP90AB1NPSR1LMNAALDH1A1
SCHEMBL17973999 0.72 HSP90AA1 (0.64) HSP90AA1HSP90AB1NPSR1LMNAALDH1A1
SCHEMBL6081855 0.71 PGR (0.46) NPSR1LMNAALDH1A1KMT2ASMN1; SMN2
SCHEMBL6651775 0.71 HSP90AA1 (0.68) HSP90AA1HSP90AB1NPSR1LMNAALDH1A1
SCHEMBL17969780 0.71 FGFR1 (0.88) HSP90AA1HSP90AB1NPSR1LMNAALDH1A1
SCHEMBL17969798 0.71 HSP90AA1 (0.68) HSP90AA1HSP90AB1NPSR1LMNAALDH1A1

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-6063534-A CHARGE TRANSPORTING AGENTS HAVING A HIGH PHOTOSENSITIVITY, A LOW RESIDUAL POTENTIAL AND CAPABLE OF STABLY FORMING A HIGHLY-DENSE VIVID IMAGE WITHOUT BACKGROUND FOGGING; 2-PHENYL-3-NITRO-SUBSTITUTED HYDROCARBYLOXO-)NAPHTHAQUINONES MITA INDUSTRIAL CO., LTD. (JP) 2000-05-16 US claimed
US-6063534-A CHARGE TRANSPORTING AGENTS HAVING A HIGH PHOTOSENSITIVITY, A LOW RESIDUAL POTENTIAL AND CAPABLE OF STABLY FORMING A HIGHLY-DENSE VIVID IMAGE WITHOUT BACKGROUND FOGGING; 2-PHENYL-3-NITRO-SUBSTITUTED HYDROCARBYLOXO-)NAPHTHAQUINONES MITA INDUSTRIAL CO., LTD. (JP) 2000-05-16 US disclosed
US-6022658-A SENSITIVE ELECTRON TRANSFERRING COMPOUND MITA INDUSTRIAL CO LTD. (JP) 2000-02-08 US disclosed