SCHEMBL20162100

SCHEMBL20162100

C=COC(=C)C(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
SCHEMBL29209904 0.78
SCHEMBL2780173 0.74
SCHEMBL218488 0.74
SCHEMBL10897451 0.74 TDP1 (0.41)
SCHEMBL29239621 0.74 ALDH1A1 (0.35)
SCHEMBL7529535 0.73 ALDH1A1 (0.44)
SCHEMBL1438 0.73
SCHEMBL9756695 0.72
SCHEMBL35971 0.72
SCHEMBL9754410 0.72

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
US-20230248682-A1 COMPOSITION FOR TREATING ATOPY OR PRURITUS COMPRISING N-ACETYL OR N-ACYL AMINO ACID STEMDR INC. (KR) 2023-08-10 US disclosed
US-20230248682-A1 COMPOSITION FOR TREATING ATOPY OR PRURITUS COMPRISING N-ACETYL OR N-ACYL AMINO ACID STEMDR INC. (KR) 2023-08-10 US disclosed
US-20200316001-A1 COMPOSITION FOR TREATING ATOPY OR PRURITUS CONTAINING N-ACETYL OR N-ACYLAMINO ACID STEMDR INC. (KR) 2020-10-08 US disclosed
EP-3323017-A1 LASER-ABLATABLE MASK FILM Flint Group Germany GmbH (DE) 2018-05-23 EP disclosed