SCHEMBL1506328

SCHEMBL1506328

O=BOc1c[nH]c(=O)[nH]c1=O

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
DPYD Q12882 5/20 0.44
ALDH1A1 P00352 3/20 0.43
MAPT P10636 3/20 0.43
LMNA P02545 3/20 0.43
GAA P10253 2/20 0.43
ATAD2 Q6PL18 1/20 0.43
CYP19A1 P11511 1/20 0.43
TSHR P16473 1/20 0.43
THPO P40225 1/20 0.43
MTOR P42345 1/20 0.43
HTT P42858 1/20 0.43
HBB P68871 1/20 0.43
PMP22 Q01453 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
KDM4C Q9H3R0 1/20 0.35

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
SCHEMBL31090687 0.78 DPYD (0.50) DPYDALDH1A1MAPTLMNAGAA
SCHEMBL327290 0.72 DPYD (0.45) DPYDALDH1A1MAPTLMNAGAA
SCHEMBL1061623 0.71 GAA (0.48) DPYDALDH1A1MAPTLMNAGAA
SCHEMBL5075425 0.69 SLC22A6 (0.47) DPYDALDH1A1MAPTLMNAGAA
SCHEMBL6647291 0.69 POLB (0.50) DPYDALDH1A1MAPTLMNAGAA
SCHEMBL1916526 0.69 ATAD2 (0.47) DPYDALDH1A1MAPTLMNAGAA
SCHEMBL17991917 0.68 GAA (0.45) DPYDALDH1A1MAPTLMNAGAA
SCHEMBL103605 0.67 GAA (0.44) DPYDALDH1A1MAPTLMNAGAA
SCHEMBL29756976 0.67 DPYD (0.43) DPYD
Formaldehyde SCHEMBL28861115 0.67 POLB (0.48) DPYDALDH1A1MAPTLMNAGAA

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
EP-2386556-B1 Benzothiazole cyclobutyl amine derivatives and their use as histamine-3 receptors ligands ABBVIE INC (US) 2013-10-23 EP disclosed
EP-1926729-B1 BENZOTHIAZOLE CYCLOBUTYL AMINE DERIVATIVES AND THEIR USE AS HISTAMINE-3 RECEPTORS LIGANDS ABBOTT LAB (US) 2011-12-21 EP disclosed
EP-2386556-A1 Benzothiazole cyclobutyl amine derivatives and their use as histamine-3 receptors ligands Abbott Laboratories (US) 2011-11-16 EP disclosed
EP-1888523-B1 CYCLOBUTYL AMINE DERIVATIVES ABBOTT LAB (US) 2011-10-26 EP disclosed
US-20110254413-A1 CASING OF ELECTRONIC DEVICE AND MANUFACTURING METHOD THEREOF ASUSTEK COMPUTER INC. (TW) 2011-10-20 US disclosed
EP-2298734-A2 Cyclobutyl amine derivatives Abbott Laboratories (US) 2011-03-23 EP disclosed