SCHEMBL4388036

SCHEMBL4388036

CC(Br)N1CCCC1

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
SCHEMBL6329689 0.97
SCHEMBL194338 0.73
SCHEMBL4911003 0.72
SCHEMBL2499397 0.72 FDPS (0.33)
SCHEMBL24233286 0.72 SMN1; SMN2 (0.40)
SCHEMBL24496310 0.72 CHRNA7 (0.42)
SCHEMBL57304 0.72
SCHEMBL382220 0.71
SCHEMBL840412 0.69 CHRNA7 (0.41)
SCHEMBL24435951 0.69 CHRNA7 (0.40)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8193394-B2 Process for production of lasofoxifene or analogue thereof TOKYO UNIVERSITY OF SCIENCE EDUCATIONAL FOUNDATION ADMINISTRATIVE ORGANIZATION (JP) 2012-06-05 US disclosed
US-20090012314-A1 Process for Production of Lasofoxifene or Analogue Thereof TOKYO UNIVERSITY OF SCIENCE EDUCATIONAL FOUNDATION ADMINISTRATIVE ORGANIZATION (JP) 2009-01-08 US disclosed
EP-1982981-A1 PROCESS FOR PRODUCTION OF LASOFOXIFENE OR ANALOGUE THEREOF Tokyo University of Science, Educational Foundation (JP) 2008-10-22 EP disclosed
US-5908863-A ANTIGROWTH AGENT FOR BONES DOMPE' S.P.A. (IT) 1999-06-01 US disclosed
EP-0792878-A2 Geminal carboxylic acids and esters thereof, pharmaceutical formulations containing them useful in the treatment of bone dysmetabolism Dompé S.P.A. (IT) 1997-09-03 EP disclosed