Ethoxycarbonyl Group

Ethoxycarbonyl Group

SCHEMBL28823657

CCOC=O.O=S(=O)(c1ccccc1)n1ccc2cc(Cl)ccc21

nearest known ligand 0.55

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 16/20 0.55
POLB P06746 1/20 0.55
L3MBTL1 Q9Y468 1/20 0.55
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
ALDH1A1 P00352 1/20 0.49
LMNA P02545 1/20 0.49
HPGD P15428 1/20 0.49
TSHR P16473 1/20 0.49
HTT P42858 1/20 0.49
HDAC3 O15379 2/20 0.45
HDAC4 P56524 2/20 0.45
HDAC1 Q13547 2/20 0.45
HDAC7 Q8WUI4 2/20 0.45
HDAC2 Q92769 2/20 0.45
HDAC10 Q969S8 2/20 0.45
HDAC11 Q96DB2 2/20 0.45
HDAC8 Q9BY41 2/20 0.45
HDAC6 Q9UBN7 2/20 0.45
HDAC9 Q9UKV0 2/20 0.45

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
Ethoxycarbonyl Group SCHEMBL27814870 0.90 HTR6 (0.53) HTR6POLBL3MBTL1HDAC1PPARG
Ethoxycarbonyl Group SCHEMBL27701550 0.86 HTR6 (0.68) HTR6POLBL3MBTL1MEN1KMT2A
SCHEMBL428128 0.85 HTR6 (0.68) HTR6POLBL3MBTL1MEN1KMT2A
Ethoxycarbonyl Group SCHEMBL27682289 0.79 HTR6 (0.47) HTR6MEN1KMT2ALMNA
SCHEMBL27733772 0.79 HTR6 (0.51) HTR6POLBL3MBTL1MEN1KMT2A
Ethoxycarbonyl Group SCHEMBL28073916 0.78 HTR6 (0.56) HTR6POLBL3MBTL1MEN1KMT2A
SCHEMBL19181960 0.75 HTR6 (0.47) HTR6POLBL3MBTL1MEN1KMT2A
Ethoxycarbonyl Group SCHEMBL27580233 0.75 MEN1 (0.58) HTR6POLBL3MBTL1MEN1KMT2A
Ethoxycarbonyl Group SCHEMBL27418243 0.75 HTR2A (0.49) POLB
SCHEMBL4446722 0.75 HTR6 (0.59) HTR6POLBL3MBTL1LMNAHTT

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
CN-105431419-A Novel aza-oxo-indoles for the treatment and prophylaxis of respiratory syncytial virus infection HOFFMANN-LA ROCHE AG 2016-03-23 CN disclosed
CN-105408330-A Novel aza-oxo-indoles for the treatment and prophylaxis of respiratory syncytial virus infection HOFFMANN LA ROCHE 2016-03-16 CN disclosed