SCHEMBL1695010

SCHEMBL1695010

O=CC(Br)N1CCCCC1

nearest known ligand 0.36

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
FDPS P14324 2/20 0.36
LMNA P02545 1/20 0.35
MAPT P10636 1/20 0.35
HTT P42858 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
SCHEMBL1037995 0.97
SCHEMBL4063891 0.75 MAPT (0.48) LMNAMAPT
SCHEMBL4430883 0.72 FDPS (0.39) FDPSLMNAMAPTHTT
SCHEMBL4670328 0.72 SIGMAR1 (0.38)
SCHEMBL20189364 0.69
SCHEMBL15955662 0.68 DPP7 (0.38) FDPSLMNAMAPTHTT
SCHEMBL1120453 0.68 LMNA (0.45) FDPSLMNAMAPTHTT
SCHEMBL22412645 0.68 LMNA (0.45) FDPSLMNAMAPTHTT
SCHEMBL3132292 0.68 FDPS (0.36) FDPSLMNAMAPTHTT
SCHEMBL8742797 0.68 FDPS (0.36) FDPSLMNAMAPTHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109575044-A 2-(camptothecine -10- oxygroup) acetamides and application 西安交通大学 2019-04-05 CN disclosed
EP-3380484-A1 NEW 6-OXA-3,9, 15-TRIAZA-BICYCLO[9.3.1 ]PENTADEC A- 1 ( 14), 1 1 ( 15), 12-TRIENE DERIVATIVES BASED COMPOUNDS AND THEIR APPLICATION AS LIGANDS OF ESSENTIAL METAL ION BASED MRI AND 52MN BASED PET CONTRAST AGENTS Debreceni Egyetem (HU) 2018-10-03 EP disclosed
EP-3380472-A1 NEW 3,6,9, 15-TETRAAZA-BICYCLO [9.3.1 ]PENTADECA- 1(14), 11(15), 12-TRIENE BASED COMPOUNDS AND THEIR APPLICATION AS LIGANDS OF ESSENTIAL METAL ION BASED MRI AND 52MN BASED PET CONTRAST AGENTS Debreceni Egyetem (HU) 2018-10-03 EP disclosed
WO-2017089849-A1 NEW 6-OXA-3,9, 15-TRIAZA-BICYCLO[9.3.1 ]PENTADEC A- 1 ( 14), 1 1 ( 15), 12-TRIENE DERIVATIVES BASED COMPOUNDS AND THEIR APPLICATION AS LIGANDS OF ESSENTIAL METAL ION BASED MRI AND 52MN BASED PET CONTRAST AGENTS DEBRECENI EGYETEM (HU) 2017-06-01 WO disclosed
WO-2017089847-A1 NEW 3,6,9, 15-TETRAAZA-BICYCLO [9.3.1 ]PENTADECA- 1(14), 11(15), 12-TRIENE BASED COMPOUNDS AND THEIR APPLICATION AS LIGANDS OF ESSENTIAL METAL ION BASED MRI AND 52MN BASED PET CONTRAST AGENTS DEBRECENI EGYETEM (HU) 2017-06-01 WO disclosed
EP-2593112-A2 NOVEL ANTIBACTERIAL COMPOUNDS, METHODS OF MAKING THEM, AND USES THEREOF Albany Molecular Research, Inc. (US) 2013-05-22 EP disclosed
WO-2012006321-A2 NOVEL ANTIBACTERIAL COMPOUNDS, METHODS OF MAKING THEM, AND USES THEREOF ALBANY MOLECULAR RESEARCH, INC. (US) 2012-01-12 WO disclosed