SCHEMBL28071195

SCHEMBL28071195

CCCC(O)(Br)C(O)(O)C(O)(O)O

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
FDPS P14324 1/20 0.33
ESR1 P03372 1/20 0.30
ESR2 Q92731 1/20 0.30

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
SCHEMBL16970344 0.71 FDPS (0.36) FDPSESR1ESR2
SCHEMBL11086767 0.69
SCHEMBL4950890 0.69
SCHEMBL28654244 0.67
SCHEMBL29242641 0.67 FDPS (0.33) FDPS
SCHEMBL16005284 0.67 FDPS (0.37) FDPS
SCHEMBL3458842 0.65 FDPS (0.41) FDPSESR1ESR2
SCHEMBL28738173 0.65
SCHEMBL28890244 0.65 FDPS (0.36) FDPSESR1ESR2
SCHEMBL5032751 0.63 FDPS (0.39) FDPS

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105801364-A Preparation method of brominated hexanehexol 广西梧州制药(集团)股份有限公司 2016-07-27 CN claimed
CN-105801374-A Synthetic method capable of improving yield of bromohexanehexol reaction product 广西梧州制药(集团)股份有限公司 2016-07-27 CN claimed
CN-105801364-A Preparation method of brominated hexanehexol 广西梧州制药(集团)股份有限公司 2016-07-27 CN disclosed
CN-105801374-A Synthetic method capable of improving yield of bromohexanehexol reaction product 广西梧州制药(集团)股份有限公司 2016-07-27 CN disclosed
CN-105801374-A Synthetic method capable of improving yield of bromohexanehexol reaction product 广西梧州制药(集团)股份有限公司 2016-07-27 CN disclosed
CN-105801374-A Synthetic method capable of improving yield of bromohexanehexol reaction product 广西梧州制药(集团)股份有限公司 2016-07-27 CN disclosed