SCHEMBL13092425

SCHEMBL13092425

CN1CC(O)CC1C=O

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
SCHEMBL3478880 1.00
SCHEMBL20342123 1.00
SCHEMBL28176953 0.80
SCHEMBL18869797 0.78 LMNA (0.37)
SCHEMBL24163835 0.77 ATM (0.41)
SCHEMBL13789969 0.74
SCHEMBL10266427 0.74
SCHEMBL12247762 0.74
SCHEMBL28091576 0.74
SCHEMBL26207631 0.74 ATM (0.39)

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-9371362-B2 Prostate specific antigen agents and methods of using same for prostate cancer imaging VISEN MEDICAL, INC. (US) 2016-06-21 US disclosed
WO-2015058868-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF CANCER PANGAEA BIOTECH, S.L. (ES) 2015-04-30 WO disclosed
US-20140050662-A1 PROSTATE SPECIFIC ANTIGEN AGENTS AND METHODS OF USING SAME FOR PROSTATE CANCER IMAGING VISEN MEDICAL, INC. 2014-02-20 US disclosed
EP-0854140-B1 Vitronectin receptor antagonists, their production and their use SANOFI AVENTIS DEUTSCHLAND (DE) 2013-11-06 EP disclosed
EP-1570835-B1 Composition for the permanent deformation of the hair comprising at least one carboxydithiol OREAL (FR) 2010-10-20 EP disclosed