SCHEMBL6636451

SCHEMBL6636451

CCCN(CO)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
SCHEMBL41505 0.86 CA12 (0.55)
SCHEMBL28518442 0.85 CA12 (0.52)
Bromide SCHEMBL11753648 0.83 CA12 (0.52)
Hydrochloric Acid SCHEMBL10822973 0.83 CA12 (0.52)
SCHEMBL77048 0.82 CA12 (0.46)
SCHEMBL4632079 0.82 CA12 (0.46)
SCHEMBL11050263 0.81 CA12 (0.47)
SCHEMBL331800 0.81
Hydrochloric Acid SCHEMBL10822894 0.79 CA12 (0.48)
SCHEMBL6142653 0.78 CA12 (0.43)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1423356-A2 NOVEL AMINOBENZOEPHENONES Leo Pharma A/S (DK) 2004-06-02 EP claimed
WO-2003018535-A2 NOVEL AMINOBENZOEPHENONES LEO PHARMA A/S (DK) 2003-03-06 WO claimed
EP-1423356-A2 NOVEL AMINOBENZOEPHENONES Leo Pharma A/S (DK) 2004-06-02 EP disclosed
WO-2003018535-A2 NOVEL AMINOBENZOEPHENONES LEO PHARMA A/S (DK) 2003-03-06 WO disclosed