SCHEMBL6582192

SCHEMBL6582192

CCCCCCN(C(=O)COCc1ccccc1)c1cc([N+](=O)[O-])ccc1C(=O)OCC

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.42
MAPK1 P28482 3/20 0.42
ALDH1A1 P00352 3/20 0.42
TDP1 Q9NUW8 2/20 0.42
KMT2A Q03164 2/20 0.42
AR P10275 2/20 0.41
CACNA1F O60840 1/20 0.40
CACNA1D Q01668 1/20 0.40
CACNA1S Q13698 1/20 0.40
CACNA1C Q13936 1/20 0.40
MAPT P10636 1/20 0.40
TP53 P04637 1/20 0.38
PDE1C Q14123 1/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
CYP3A4 P08684 1/20 0.38
TSHR P16473 1/20 0.38
ELANE P08246 1/20 0.37
RAB9A P51151 1/20 0.37
LMNA P02545 1/20 0.37
MEN1 O00255 1/20 0.37

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
SCHEMBL6577093 0.93 SMN1; SMN2 (0.42) SMN1; SMN2ALDH1A1TDP1KMT2ACACNA1F
SCHEMBL6576899 0.88 SMN1; SMN2 (0.46) SMN1; SMN2ALDH1A1TDP1KMT2ACACNA1F
SCHEMBL6579645 0.88 AR (0.48) SMN1; SMN2MAPK1ALDH1A1TDP1KMT2A
SCHEMBL6579803 0.85 ALDH1A1 (0.40) SMN1; SMN2MAPK1ALDH1A1TDP1KMT2A
SCHEMBL6579278 0.85 SMN1; SMN2 (0.46) SMN1; SMN2MAPK1ALDH1A1TDP1KMT2A
SCHEMBL6579094 0.84 SMN1; SMN2 (0.46) SMN1; SMN2ALDH1A1TDP1KMT2ACACNA1F
SCHEMBL6577428 0.84 SMN1; SMN2 (0.46) SMN1; SMN2ALDH1A1TDP1KMT2ACACNA1F
SCHEMBL6578789 0.84 SMN1; SMN2 (0.47) SMN1; SMN2MAPK1ALDH1A1KMT2AAR
SCHEMBL6579241 0.84 SMN1; SMN2 (0.44) SMN1; SMN2ALDH1A1TDP1KMT2ACACNA1F
SCHEMBL6579467 0.83 SMN1; SMN2 (0.45) SMN1; SMN2MAPK1ALDH1A1TDP1KMT2A

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-0927718-B1 Quinolinone derivative, method for preparing the same, and anti-allergic agent DAINIPPON INK & CHEMICALS (JP) 2004-02-25 EP disclosed
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