SCHEMBL7964554

SCHEMBL7964554

CCOC(=O)c1ccc([N+](=O)[O-])cc1N(C)C(=O)COc1ccccn1

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.46
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
MAPT P10636 2/20 0.42
GAA P10253 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
ALDH1A1 P00352 2/20 0.42
ELANE P08246 1/20 0.42
LMNA P02545 2/20 0.40
PDE4B Q07343 1/20 0.40
PDE4D Q08499 1/20 0.40
TP53 P04637 1/20 0.40
PTGS2 P35354 1/20 0.39

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
SCHEMBL6578873 0.86 SMN1; SMN2 (0.49) SMN1; SMN2MEN1KMT2AMAPTALDH1A1
SCHEMBL6581956 0.82 SMN1; SMN2 (0.54) SMN1; SMN2MEN1KMT2AMAPTALDH1A1
SCHEMBL6581391 0.81 SMN1; SMN2 (0.48) SMN1; SMN2MEN1KMT2AMAPTGAA
SCHEMBL6576522 0.81 SMN1; SMN2 (0.48) SMN1; SMN2MEN1KMT2AMAPTGAA
SCHEMBL6581968 0.80 KMT2A (0.49) SMN1; SMN2MEN1KMT2AMAPTGAA
SCHEMBL6578789 0.80 SMN1; SMN2 (0.47) SMN1; SMN2MEN1KMT2AMAPTL3MBTL1
SCHEMBL6582119 0.79 SMN1; SMN2 (0.51) SMN1; SMN2MEN1KMT2AMAPTGAA
SCHEMBL8004126 0.79 SMN1; SMN2 (0.60) SMN1; SMN2MEN1KMT2AMAPTALDH1A1
SCHEMBL6578940 0.78 SMN1; SMN2 (0.49) SMN1; SMN2MEN1KMT2AMAPTALDH1A1
SCHEMBL6579764 0.77 SMN1; SMN2 (0.48) SMN1; SMN2MEN1KMT2AMAPTGAA

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-6271416-B1 O-(HYDROCARBONOXYACETAMIDO)BENZOIC ACID DERIVATIVES AS INTERMEDIATES DAINIPPON INK AND CHEMICALS, INC. (JP) 2001-08-07 US disclosed
US-6136822-A ETHER, HYDROXY QUINOLINONE COMPOUNDS DAINIPPON INK AND CHEMICALS, INC. (JP) 2000-10-24 US disclosed
EP-0927718-A1 Quinolinone derivative, method for preparing the same, and anti-allergic agent DAINIPPON INK AND CHEMICALS, INC. (JP) 1999-07-07 EP disclosed