SCHEMBL7997575

SCHEMBL7997575

CC(=O)Oc1c(OCC=C(C)C)c2ccc([N+](=O)[O-])cc2n(C)c1=O

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.39
KDM4E B2RXH2 3/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
RECQL P46063 1/20 0.39
MAPT P10636 7/20 0.37
LMNA P02545 2/20 0.37
HTT P42858 2/20 0.36
POLB P06746 1/20 0.36
MAPK1 P28482 1/20 0.36
ACHE P22303 1/20 0.35
CYP1B1 Q16678 1/20 0.35
PDE4A P27815 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.34
GAA P10253 2/20 0.34
CYP1A2 P05177 1/20 0.34

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
SCHEMBL8000789 0.93 TDP1 (0.42) ALDH1A1KDM4ESMN1; SMN2MEN1KMT2A
SCHEMBL8000786 0.93 TDP1 (0.42) ALDH1A1KDM4ESMN1; SMN2MEN1KMT2A
SCHEMBL8001120 0.90 MAPT (0.39) ALDH1A1KDM4EMEN1KMT2AMAPT
SCHEMBL7997461 0.88 CYP1A2 (0.42) ALDH1A1KDM4ESMN1; SMN2MEN1KMT2A
SCHEMBL7988407 0.88 MAPT (0.36) ALDH1A1SMN1; SMN2MEN1KMT2AMAPT
SCHEMBL7998950 0.88 HTR1A (0.37) ALDH1A1KDM4ESMN1; SMN2MEN1KMT2A
SCHEMBL8004395 0.87 KDM4E (0.45) ALDH1A1KDM4ESMN1; SMN2MEN1KMT2A
SCHEMBL8004269 0.87 TDP1 (0.43) ALDH1A1KDM4EMEN1KMT2AMAPT
SCHEMBL8004263 0.87 TDP1 (0.43) ALDH1A1KDM4EMEN1KMT2AMAPT
SCHEMBL8000875 0.87 MAPT (0.35) ALDH1A1SMN1; SMN2MEN1KMT2AMAPT

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-6114352-A Quinolinone derivative and anti-allergic agent with said quinolinone derivative as the active ingredient DAINIPPON INK AND CHEMICALS, INC. (JP) 2000-09-05 US disclosed
EP-0785190-B1 Quinolinone derivative and antiallergic agent with said quinolinone derivative as the active ingredient DAINIPPON INK & CHEMICALS (JP) 2000-08-16 EP disclosed
US-5942521-A Quinolinone derivative and anti-allergic agent with said quinolinone derivative as the active ingredient DAINIPPON INK AND CHEMICALS, INC. (JP) 1999-08-24 US disclosed
EP-0785190-A2 Quinolinone derivative and antiallergic agent with said quinolinone derivative as the active ingredient DAINIPPON INK AND CHEMICALS, INC. (JP) 1997-07-23 EP disclosed