SCHEMBL1443472

SCHEMBL1443472

CC(CN)(CN)C(O)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
SCHEMBL6545233 0.78
SCHEMBL2454366 0.69
SCHEMBL6688951 0.69
SCHEMBL31318035 0.67 FDPS (0.39)
Hydrochloric Acid SCHEMBL5551896 0.67 CYP2D6 (0.39)
SCHEMBL28778188 0.67
SCHEMBL3798601 0.67
SCHEMBL23186679 0.65 CYP2D6 (0.37)
SCHEMBL6516234 0.65
SCHEMBL21756625 0.65 ALDH1A1 (0.37)

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-6221906-B1 ANTICANCER AGENTS KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2001-04-24 US claimed
EP-1082331-A1 PLATINUM COMPLEX CONJUGATED TO CYCLOTRIPHOSPHAZENE, ITS PREPARATION, AND ANTICANCER AGENT COMPRISING THE SAME KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2001-03-14 EP claimed
WO-2000058321-A1 PLATINUM COMPLEX CONJUGATED TO CYCLOTRIPHOSPHAZENE, ITS PREPARATION, AND ANTICANCER AGENT COMPRISING THE SAME KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2000-10-05 WO claimed
EP-2475673-A1 CYCLOBUTAN-1,1 -DICARBOXYLATO COMPLEXES OF PLATINUM WITH N6-BENZYLADENINE DERIVATIVES, METHOD OF THEIR PREPARATION AND APPLICATION OF THESE COMPLEXES AS DRUGS IN ANTITUMOUR THERAPY Univerzita Palackeho (CZ) 2012-07-18 EP disclosed
WO-2011029415-A1 CYCLOBUTAN-1,1 -DICARBOXYLATO COMPLEXES OF PLATINUM WITH N6-BENZYLADENINE DERIVATIVES, METHOD OF THEIR PREPARATION AND APPLICATION OF THESE COMPLEXES AS DRUGS IN ANTITUMOUR THERAPY UNIVERZITA PALACKEHO (CZ) 2011-03-17 WO disclosed
US-6221906-B1 ANTICANCER AGENTS KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2001-04-24 US disclosed
EP-1082331-A1 PLATINUM COMPLEX CONJUGATED TO CYCLOTRIPHOSPHAZENE, ITS PREPARATION, AND ANTICANCER AGENT COMPRISING THE SAME KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2001-03-14 EP disclosed
WO-2000058321-A1 PLATINUM COMPLEX CONJUGATED TO CYCLOTRIPHOSPHAZENE, ITS PREPARATION, AND ANTICANCER AGENT COMPRISING THE SAME KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2000-10-05 WO disclosed