SCHEMBL366305

SCHEMBL366305

COC(=O)c1c2ccccc2n2cc(C(O)CN(C)C)ccc12

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NR4A2 P43354 4/20 0.41
IDO1 P14902 1/20 0.40
GAA P10253 1/20 0.39
KMT2A Q03164 4/20 0.39
MEN1 O00255 2/20 0.39
LMNA P02545 2/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
DNM1 Q05193 2/20 0.38
UTS2R Q9UKP6 1/20 0.37
ALDH1A1 P00352 2/20 0.37
KDM4E B2RXH2 1/20 0.37
THRB P10828 1/20 0.37
TSHR P16473 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
BRD4 O60885 1/20 0.35
EGFR P00533 1/20 0.35
SRC P12931 1/20 0.35
PTGER4 P35408 1/20 0.35
MAPT P10636 1/20 0.35

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
SCHEMBL366730 0.87 NR4A2 (0.43) NR4A2IDO1GAAKMT2AMEN1
SCHEMBL365901 0.82 NR4A2 (0.39) NR4A2IDO1GAAKMT2AMEN1
SCHEMBL366304 0.82 MAPT (0.44) IDO1GAAKMT2AMEN1LMNA
SCHEMBL365054 0.81 NR4A2 (0.46) NR4A2IDO1GAAKMT2AMEN1
SCHEMBL364933 0.79 NR4A2 (0.42) NR4A2IDO1GAAKMT2AMEN1
SCHEMBL365946 0.78 ALDH1A1 (0.47) GAAKMT2AMEN1LMNAUTS2R
SCHEMBL358633 0.77 KMT2A (0.38) NR4A2IDO1GAAKMT2AMEN1
SCHEMBL365429 0.77 TSHR (0.37) NR4A2IDO1GAAKMT2AMEN1
SCHEMBL366048 0.76 NR4A2 (0.36) NR4A2IDO1GAAKMT2AMEN1
SCHEMBL365515 0.75 NR4A2 (0.35) NR4A2IDO1GAAKMT2AMEN1

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