SCHEMBL366048

SCHEMBL366048

COC(=O)c1c2ccccc2n2cc(OC(CC(N)=O)CN(C)C)ccc12

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR4A2 P43354 3/20 0.36
GAA P10253 1/20 0.35
KMT2A Q03164 5/20 0.35
LMNA P02545 4/20 0.35
MEN1 O00255 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
TSHR P16473 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
F10 P00742 1/20 0.34
GABRP O00591 2/20 0.34
GABRD O14764 2/20 0.34
GABRA1 P14867 2/20 0.34
GABRB1 P18505 2/20 0.34
GABRG2 P18507 2/20 0.34
GABRB3 P28472 2/20 0.34
GABRA5 P31644 2/20 0.34
GABRA3 P34903 2/20 0.34
GABRA2 P47869 2/20 0.34
GABRB2 P47870 2/20 0.34
GABRA4 P48169 2/20 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
SCHEMBL358633 0.91 KMT2A (0.38) NR4A2GAAKMT2ALMNAMEN1
SCHEMBL365429 0.91 TSHR (0.37) NR4A2GAAKMT2ALMNAMEN1
SCHEMBL365515 0.85 NR4A2 (0.35) NR4A2GAAKMT2ALMNAMEN1
SCHEMBL366047 0.85 KMT2A (0.48) GAAKMT2ALMNAMEN1SMN1; SMN2
SCHEMBL365340 0.85 NR4A2 (0.39) NR4A2GAAKMT2ALMNAMEN1
SCHEMBL364860 0.79 KMT2A (0.39) NR4A2GAAKMT2ALMNAMEN1
SCHEMBL364924 0.78 ALDH1A1 (0.40) GAAKMT2ALMNAMEN1SMN1; SMN2
SCHEMBL366161 0.77 ELANE (0.37) NR4A2GAAKMT2ALMNAMEN1
SCHEMBL365428 0.77 KMT2A (0.47) GAAKMT2ALMNAMEN1SMN1; SMN2
SCHEMBL358632 0.77 KMT2A (0.47) GAAKMT2ALMNAMEN1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2012007007-A1 INHIBITORS OF HDME EPITHERAPEUTICS APS (DK) 2012-01-19 WO claimed
WO-2012007007-A1 INHIBITORS OF HDME EPITHERAPEUTICS APS (DK) 2012-01-19 WO disclosed