SCHEMBL8225520

SCHEMBL8225520

CC(=O)CC1=CC=CCC1

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
SCHEMBL20262295 0.82
SCHEMBL7118503 0.82 POLB (0.33)
SCHEMBL6200283 0.82
SCHEMBL12973206 0.81 ALDH1A1 (0.37)
SCHEMBL23784196 0.80
SCHEMBL4287984 0.80 ALDH1A1 (0.32)
SCHEMBL11099311 0.80
SCHEMBL14399314 0.80 CA2 (0.32)
SCHEMBL14307355 0.80
SCHEMBL28304209 0.79 HSP90AB1 (0.38)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3170807-A1 NEW METHOD FOR SYNTHESIS OF FENFLURAMINE, OF ISOMERS THEROF AND/OR OF ANALOGS THEREOF, AND NEW COMPOSITIONS COMPRISING IT Frau Pharma S.r.l. (IT) 2017-05-24 EP disclosed
US-20090325208-A1 Biosynthesis of Salinosporamide A and Analogs and Methods Thereof THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2009-12-31 US disclosed
WO-2008002600-A2 BIOSYNTHESIS OF SALINOSPORAMIDE A AND ANALOGS AND METHODS THEREOF THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2008-01-03 WO disclosed