SCHEMBL31024136

SCHEMBL31024136

C=C/C=C\CC1=C(C)CCC1=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
SCHEMBL11804434 1.00
SCHEMBL11804426 1.00
SCHEMBL4396504 0.80 NPSR1 (0.30)
SCHEMBL11804819 0.79
SCHEMBL3110758 0.79
SCHEMBL20384 0.79
Cis-Jasmone SCHEMBL17629672 0.77 TRPA1 (0.30)
Cis-Jasmone SCHEMBL57545 0.77 TRPA1 (0.30)
Cis-Jasmone SCHEMBL901284 0.77 TRPA1 (0.30)
Cis-Jasmone SCHEMBL20385 0.77 TRPA1 (0.30)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4676226-A1 ANTIFUNGAL COMPOSITIONS COMPRISING NATAMYCIN Patent Nata B.V. (NL) 2026-01-14 EP disclosed
WO-2024186207-A1 ANTIFUNGAL COMPOSITIONS COMPRISING NATAMYCIN CERADIS PATENT B.V. (NL) 2024-09-12 WO disclosed