SCHEMBL9717004

SCHEMBL9717004

O=C(O)c1cc2c(c(Cl)c1C(=O)O)C(=O)c1ccccc1C2=O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TTR P02766 6/20 0.55
ALDH1A1 P00352 5/20 0.54
L3MBTL1 Q9Y468 2/20 0.54
MAPT P10636 8/20 0.50
LMNA P02545 2/20 0.50
KMT2A Q03164 5/20 0.49
MEN1 O00255 4/20 0.49
MAPK1 P28482 4/20 0.49
THRB P10828 2/20 0.49
POLB P06746 1/20 0.49
RECQL P46063 1/20 0.49
KDM4E B2RXH2 2/20 0.48
PKM P14618 2/20 0.48
MCL1 Q07820 2/20 0.48
USP2 O75604 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48
PKLR P30613 1/20 0.47
SMN1; SMN2 Q16637 2/20 0.46
MMP14 P50281 1/20 0.46
CYP1A2 P05177 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
SCHEMBL11432637 0.80 TTR (0.71) TTRALDH1A1L3MBTL1MAPTLMNA
SCHEMBL11220754 0.79 TTR (0.60) TTRALDH1A1L3MBTL1MAPTLMNA
SCHEMBL3453760 0.79 MAPT (0.66) TTRALDH1A1L3MBTL1MAPTLMNA
SCHEMBL4054817 0.79 MAPT (0.59) TTRALDH1A1L3MBTL1MAPTLMNA
SCHEMBL11335735 0.78 TTR (0.53) TTRALDH1A1L3MBTL1MAPTLMNA
SCHEMBL7096608 0.76 PKLR (0.71) TTRALDH1A1L3MBTL1MAPTLMNA
SCHEMBL27642810 0.76 MAPT (0.64) TTRALDH1A1L3MBTL1MAPTLMNA
SCHEMBL68338 0.75 TTR (0.64) TTRALDH1A1L3MBTL1MAPTLMNA
SCHEMBL7055073 0.75 TTR (0.55) TTRALDH1A1L3MBTL1MAPTLMNA
SCHEMBL11278222 0.74 CYP3A4 (0.40) TTRALDH1A1L3MBTL1POLBKDM4E

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
EP-0499450-A1 Synthesis of 1-aminoanthraquinone HOECHST CELANESE CORPORATION (US) 1992-08-19 EP disclosed
EP-0499451-A1 Synthesis of 1-amino-anthraquinone HOECHST CELANESE CORPORATION (US) 1992-08-19 EP disclosed
US-5132437-A From 2-Substituted Benzyl Compound and Xylene HOECHST CELANESE CORPORATION (US) 1992-07-21 US disclosed
US-5130448-A Condensing ortho substituted benzoic acid and xylene, oxidation, ring closure, ammonolysis and decarboxyalation HOECHST CELANESE CORPORATION (US) 1992-07-14 US disclosed