SCHEMBL2355192

SCHEMBL2355192

CCc1ccc(C[As](C)[C@H]2CCN(c3ncccc3C(=O)OC(C)C)C2)s1

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.46
LMNA P02545 1/20 0.46
KDM4E B2RXH2 1/20 0.45
POLB P06746 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
OPRK1 P41145 12/20 0.43
ALDH1A1 P00352 1/20 0.40
HRH3 Q9Y5N1 1/20 0.39
KMT2A Q03164 1/20 0.37
RBP4 P02753 1/20 0.35
TTR P02766 1/20 0.35
RECQL P46063 1/20 0.34

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
SCHEMBL2355195 1.00 MAPT (0.46) MAPTLMNAKDM4EPOLBNPSR1
SCHEMBL2223782 0.82 OPRK1 (0.51) MAPTLMNAKDM4EPOLBNPSR1
SCHEMBL2224394 0.81 MAPT (0.46) MAPTLMNAKDM4EPOLBNPSR1
SCHEMBL2224463 0.81 MAPT (0.46) MAPTLMNAKDM4EPOLBNPSR1
SCHEMBL2224263 0.78 MAPT (0.58) MAPTLMNAKDM4EPOLBNPSR1
SCHEMBL14653745 0.76 MAPT (0.57) MAPTLMNAKDM4EPOLBNPSR1
SCHEMBL2224395 0.76 MAPT (0.59) MAPTLMNAKDM4EPOLBNPSR1
SCHEMBL2223761 0.76 MAPT (0.59) MAPTLMNAKDM4EPOLBNPSR1
Hydrochloric Acid SCHEMBL2226941 0.75 MAPT (0.58) MAPTLMNAKDM4EPOLBNPSR1
SCHEMBL12516105 0.75 MAPT (0.60) MAPTLMNAKDM4EPOLBNPSR1

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-2523665-A1 VOLTAGE-GATED SODIUM CHANNEL BLOCKERS Glaxo Group Limited (GB) 2012-11-21 EP disclosed
WO-2011088201-A1 VOLTAGE-GATED SODIUM CHANNEL BLOCKERS GLAXO GROUP LIMITED (GB) 2011-07-21 WO disclosed