SCHEMBL6663062

SCHEMBL6663062

COc1ccccc1NC(=O)OCC1CCN(C(=O)OCC(C)(C)C)CC1

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
CHRM3 P20309 9/20 0.48
ALDH1A1 P00352 1/20 0.48
KMT2A Q03164 2/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
TP53 P04637 1/20 0.46
TGFBR1 P36897 1/20 0.45
ACHE P22303 1/20 0.45
BACE1 P56817 1/20 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
SCHEMBL17205165 0.89 TGFBR1 (0.57) GAASMN1; SMN2CHRM3KMT2AL3MBTL1
SCHEMBL6668372 0.87 CHRM3 (0.49) CHRM3KMT2AL3MBTL1TP53ACHE
SCHEMBL6666206 0.86 CHRM3 (0.53) CHRM3KMT2AL3MBTL1TP53
SCHEMBL6664439 0.85 CHRM3 (0.56) CHRM3KMT2AL3MBTL1TP53ACHE
SCHEMBL6668837 0.84 CHRM3 (0.49) GAASMN1; SMN2CHRM3ALDH1A1KMT2A
SCHEMBL6663459 0.82 CHRM3 (0.58) CHRM3KMT2AL3MBTL1ACHEBACE1
SCHEMBL6666229 0.80 L3MBTL1 (0.51) SMN1; SMN2CHRM3ALDH1A1KMT2AL3MBTL1
SCHEMBL6664925 0.80 KMT2A (0.56) GAASMN1; SMN2CHRM3ALDH1A1KMT2A
SCHEMBL6664428 0.80 CHRM3 (0.51) CHRM3ALDH1A1KMT2AL3MBTL1
SCHEMBL6664448 0.80 TDP1 (0.53) SMN1; SMN2CHRM3ALDH1A1KMT2AL3MBTL1

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
WO-2004014425-A1 ACTIVATORS OF SMALL CONDUCTANCE CALCIUM ACTIVATED POTASSIUM CHANNELS AND USE THEREOF GLAXO GROUP LIMITED (GB) 2004-02-19 WO disclosed