SCHEMBL1671185

SCHEMBL1671185

O=[N+]([O-])C1=CCNCC1

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL4789631 0.70 HTR2C (0.56)
SCHEMBL13431331 0.68
SCHEMBL4790049 0.66 HTR2C (0.53)
SCHEMBL1697297 0.65
SCHEMBL1672948 0.65
SCHEMBL458470 0.64
SCHEMBL14392214 0.63 LMNA (0.33)
SCHEMBL1170650 0.62 MAPT (0.35)
SCHEMBL1170651 0.62 MAPT (0.35)
SCHEMBL11803203 0.62 MAPT (0.35)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9796660-B2 Gamma amino acid building blocks WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2017-10-24 US disclosed
US-20160280632-A1 GAMMA AMINO ACID BUILDING BLOCKS WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2016-09-29 US disclosed
US-9382291-B2 Gamma amino acid building blocks WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2016-07-05 US disclosed
US-20150148523-A1 GAMMA AMINO ACID BUILDING BLOCKS WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2015-05-28 US disclosed
US-8664356-B2 Gamma amino acid building blocks WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2014-03-04 US disclosed
US-20110118440-A1 GAMMA AMINO ACID BUILDING BLOCKS WISCONSIN ALUMNI RESEARCH FOUNDATION 2011-05-19 US disclosed
WO-2011047190-A1 GAMMA AMINO ACID BUILDING BLOCKS WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2011-04-21 WO disclosed
EP-0022705-B1 DERIVATIVES OF TETRAHYDROPYRIDINYL-INDOL AND THEIR SALTS, THEIR PREPARATION, THEIR APPLICATION AS MEDICINES, AND COMPOSITIONS CONTAINING THEM ROUSSEL-UCLAF (FR) 1983-04-06 EP disclosed