SCHEMBL1831598

SCHEMBL1831598

C[PH](C)(C)CC(N)=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
SCHEMBL20724961 0.63
SCHEMBL21754692 0.62
SCHEMBL22319202 0.62
Propionamide SCHEMBL6361 0.62
SCHEMBL1289792 0.62
Propionamide SCHEMBL27662186 0.62 TDP1 (0.50)
Propionamide SCHEMBL25289008 0.60
Propionamide SCHEMBL18282467 0.60 TDP1 (0.47)
Propionamide SCHEMBL4727846 0.60
Propionamide SCHEMBL3712584 0.60

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-1753457-B1 CATIONIC BACTERIOCHLOROPHYLL DERIVATIVES AND USES THEREOF YEDA RES & DEV (IL) 2016-08-10 EP disclosed
US-8207154-B2 Palladium 31-oxo-15- methoxycarbonylmethyl- Rhodobacteriochlorin-131-(2-N3- trimethylammoniumethyl)amide acetate (salt); bacteriochlorophylls free of carbamate group; as photosensitizer for thermodynamic therapy and diagnosis; cancer, age related macular degeneration; killing viruses and bacteria YEDA RESEARCH AND DEVELOPMENT CO., LTD. (IL) 2012-06-26 US disclosed
EP-2322173-A1 Cationic bacteriochlorophyll derivatives and uses thereof YEDA RESEARCH AND DEVELOPMENT CO., LTD. (IL) 2011-05-18 EP disclosed
US-20080076748-A1 Catatonic Bacteriochlorophyll Derivatives YEDA RESEARCH AND DEVELOPMENT CO. LTD. (IL) 2008-03-27 US disclosed