SCHEMBL9747233

SCHEMBL9747233

CC(=O)c1ccc2c(ccc3[nH]c(=O)c(=O)[nH]c32)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.51
ALDH1A1 P00352 1/20 0.51
HPGD P15428 1/20 0.51
KIF11 P52732 1/20 0.46
CYP2A6 P11509 1/20 0.42
HRH4 Q9H3N8 1/20 0.42
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
TP53 P04637 1/20 0.40
SLC2A1 P11166 1/20 0.39
GRIK1 P39086 2/20 0.39
GRIA1 P42261 1/20 0.39
GRIA2 P42262 1/20 0.39
GRIA3 P42263 1/20 0.39
GRIA4 P48058 1/20 0.39
GRIK2 Q13002 1/20 0.39
GRIK3 Q13003 1/20 0.39
IL4I1 Q96RQ9 1/20 0.39
PARP1 P09874 4/20 0.38
MAOA P21397 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
SCHEMBL24247730 0.77 GRIK1 (0.56) MAPTKIF11MEN1KMT2ATP53
SCHEMBL9746812 0.72 SIRT2 (0.49) MAPTALDH1A1HPGDMEN1KMT2A
SCHEMBL3793284 0.72 CA12 (0.58) MAPTALDH1A1HPGDKIF11CYP2A6
SCHEMBL9747137 0.71 GRIN2D (0.42) MAPTALDH1A1HPGDHRH4MEN1
SCHEMBL9747658 0.71 IMPDH2 (0.47)
SCHEMBL834744 0.70 CYP2A6 (0.68) MAPTALDH1A1HPGDCYP2A6MEN1
SCHEMBL9747632 0.70 LMNA (0.45) MAPTALDH1A1HPGDMEN1KMT2A
SCHEMBL9747366 0.70 BRD4 (0.40) MAPTALDH1A1HPGDMEN1KMT2A
SCHEMBL15960260 0.70 ALDH1A1 (0.70) MAPTALDH1A1HPGDCYP2A6MEN1
SCHEMBL7165962 0.70 KDM4E (0.61) MAPTALDH1A1HPGDKIF11CYP2A6

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0511152-A2 Quinoxaline compounds, their preparation and use NOVO NORDISK A/S (DK) 1992-10-28 EP disclosed