SCHEMBL5832277

SCHEMBL5832277

CCCCCCCCCCCCOc1ccc(-c2nc3ccc(Br)cc3s2)cc1

nearest known ligand 0.56

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ATP4A P20648 4/20 0.56
ATP4B P51164 4/20 0.56
APP P05067 7/20 0.55
MAPT P10636 3/20 0.54
SULT1A1 P50225 1/20 0.46
HTT P42858 1/20 0.46
RXFP1 Q9HBX9 1/20 0.46
LMNA P02545 1/20 0.45
RAB9A P51151 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
SCHEMBL5946744 1.00 ATP4A (0.56) ATP4AATP4BAPPMAPTSULT1A1
SCHEMBL3724320 0.90 ATP4A (0.60) ATP4AATP4BAPPMAPTSULT1A1
SCHEMBL5053235 0.90 ATP4A (0.60) ATP4AATP4BAPPMAPTSULT1A1
SCHEMBL5946619 0.86 ATP4A (0.56) ATP4AATP4BAPPMAPTSULT1A1
SCHEMBL8557251 0.86 ATP4A (0.56) ATP4AATP4BAPPMAPTSULT1A1
SCHEMBL8555420 0.86 ATP4A (0.56) ATP4AATP4BAPPMAPTSULT1A1
SCHEMBL8550820 0.86 ATP4A (0.56) ATP4AATP4BAPPMAPTSULT1A1
SCHEMBL5831354 0.84 ATP4A (0.54) ATP4AATP4BAPPMAPTSULT1A1
SCHEMBL8555881 0.83 ATP4A (0.53) ATP4AATP4BAPPSULT1A1LMNA
SCHEMBL6812611 0.83 ATP4A (0.53) ATP4AATP4BAPPMAPTSULT1A1

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
US-7118787-B2 Liquid crystal alignment layer UNIVERSITY OF HULL (GB) 2006-10-10 US disclosed
US-20030099785-A1 Liquid crystal alignment layer UNIVERSITY OF HULL (GB) 2003-05-29 US disclosed