SCHEMBL9846755

SCHEMBL9846755

COC(=O)c1ccccc1-c1cn(C(=O)OC(C)(C)C)c2ccc(C)cc12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.46
KMT2A Q03164 7/20 0.45
MEN1 O00255 3/20 0.45
L3MBTL1 Q9Y468 2/20 0.45
KDM4E B2RXH2 2/20 0.43
BRD4 O60885 1/20 0.41
CREBBP Q92793 1/20 0.41
HTR6 P50406 1/20 0.39
LMNA P02545 1/20 0.39
TP53 P04637 1/20 0.39
NR4A2 P43354 2/20 0.39
ALDH1A1 P00352 3/20 0.39
PIM1 P11309 1/20 0.39
MARK3 P27448 1/20 0.39
MAP4K2 Q12851 1/20 0.39
CAMK2B Q13554 1/20 0.39
PIM3 Q86V86 1/20 0.39
PIM2 Q9P1W9 1/20 0.39
ALOX5AP P20292 1/20 0.38
THRB P10828 1/20 0.38

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
SCHEMBL9846760 0.85 L3MBTL1 (0.42) MAPTKMT2AMEN1L3MBTL1BRD4
SCHEMBL9846745 0.78 CCNB2 (0.44) MAPTKMT2AL3MBTL1LMNATP53
SCHEMBL30285064 0.77 KMT2A (0.46) MAPTKMT2AMEN1L3MBTL1KDM4E
SCHEMBL1746797 0.76 KMT2A (0.76) MAPTKMT2AMEN1L3MBTL1KDM4E
SCHEMBL29651126 0.76 KMT2A (0.76) MAPTKMT2AMEN1L3MBTL1KDM4E
SCHEMBL9846763 0.76 NR1H2 (0.51) MAPTBRD4CREBBPLMNATP53
SCHEMBL16172322 0.74 HTR6 (0.46) MAPTKMT2AMEN1L3MBTL1BRD4
SCHEMBL2111547 0.74 L3MBTL1 (0.48) MAPTKMT2AMEN1L3MBTL1BRD4
SCHEMBL15902182 0.73 HTR6 (0.46) KMT2AMEN1L3MBTL1KDM4EBRD4
SCHEMBL29443980 0.73 HTR6 (0.46) KMT2AMEN1L3MBTL1KDM4EBRD4

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-0429257-A2 Indole derivatives GLAXO GROUP LIMITED (GB) 1991-05-29 EP disclosed