SCHEMBL14488641

SCHEMBL14488641

CC(C)OC(=O)c1cccnc1N1CCN(C)CC1

nearest known ligand 0.72

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.72
LMNA P02545 1/20 0.72
L3MBTL1 Q9Y468 2/20 0.69
KDM4E B2RXH2 1/20 0.69
POLB P06746 1/20 0.69
NPSR1 Q6W5P4 1/20 0.69
CHIA Q9BZP6 1/20 0.58
KMT2A Q03164 1/20 0.47
HRH3 Q9Y5N1 1/20 0.47
CSNK1A1 P48729 1/20 0.45
ALDH1A1 P00352 2/20 0.44
USP2 O75604 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
OPRK1 P41145 1/20 0.42

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
SCHEMBL14650526 0.90 MAPT (0.61) MAPTLMNAL3MBTL1KDM4EPOLB
SCHEMBL12516130 0.89 MAPT (0.72) MAPTLMNAL3MBTL1KDM4EPOLB
SCHEMBL2222519 0.86 MAPT (0.67) MAPTLMNAL3MBTL1KDM4EPOLB
SCHEMBL7238484 0.85 CHIA (0.66) MAPTLMNAL3MBTL1KDM4EPOLB
Hydrochloric Acid SCHEMBL2222043 0.85 MAPT (0.66) MAPTLMNAL3MBTL1KDM4EPOLB
SCHEMBL2221551 0.84 MAPT (0.66) MAPTLMNAL3MBTL1KDM4EPOLB
SCHEMBL13089715 0.83 CHIA (0.67) MAPTLMNAL3MBTL1KDM4EPOLB
SCHEMBL2225986 0.83 MAPT (0.61) MAPTLMNAL3MBTL1KDM4EPOLB
SCHEMBL2222505 0.82 MAPT (0.63) MAPTLMNAL3MBTL1KDM4EPOLB
SCHEMBL2223115 0.82 MAPT (0.63) MAPTLMNAL3MBTL1KDM4EPOLB

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
EP-2729149-A1 VOLTAGE-GATED SODIUM CHANNEL BLOCKERS Glaxo Group Limited (GB) 2014-05-14 EP disclosed
WO-2013006596-A1 VOLTAGE-GATED SODIUM CHANNEL BLOCKERS GLAXO GROUP LIMITED (GB) 2013-01-10 WO disclosed