SCHEMBL2222376

SCHEMBL2222376

CCN(CC)C1(O)C=CC=CC1[C]=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
SCHEMBL3650233 0.74
SCHEMBL6477923 0.70
SCHEMBL9007784 0.63
SCHEMBL2381279 0.59
SCHEMBL2353911 0.57
SCHEMBL3621661 0.57
SCHEMBL7806421 0.55
Hydrochloric Acid SCHEMBL10698777 0.55
SCHEMBL28632672 0.53
SCHEMBL20516577 0.53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022110175-A1 COMPOSITIONS FOR SKIN CARE L'OREAL (FR) 2022-06-02 WO disclosed
US-20130004437-A1 NOVEL COMPOUND DSM IP ASSETS B.V. (NL) 2013-01-03 US disclosed
EP-2523651-A2 WATER-RESISTANT COSMETIC FORMULATIONS COMPRISING A HYDROPHOBICALLY MODIFIED VINYLPYRROLIDONE COPOLYMER BASF SE (DE) 2012-11-21 EP disclosed
US-20120288456-A1 NOVEL COMPOUND DSM IP ASSETS B.V. (NL) 2012-11-15 US disclosed
US-20120282201-A1 NOVEL COMPOUNDS DSM IP ASSETS B.V. (NL) 2012-11-08 US disclosed
WO-2011086073-A2 WATER-RESISTANT COSMETIC FORMULATIONS COMPRISING A HYDROPHOBICALLY MODIFIED VINYLPYRROLIDONE COPOLYMER BASF SE (DE) 2011-07-21 WO disclosed