SCHEMBL30879543

SCHEMBL30879543

CC(C)C(=O)O[C@H]1C[C@H]2C[C@@H]1[C@@H]1C=CC[C@H]21

nearest known ligand 0.38

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.38
GAA P10253 1/20 0.38

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

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
SCHEMBL1627945 1.00 POLB (0.38) POLBGAA
SCHEMBL29564894 1.00 POLB (0.38) POLBGAA
SCHEMBL29487239 1.00 POLB (0.38) POLBGAA
SCHEMBL17336914 0.88 GAA (0.30) POLBGAA
SCHEMBL29564962 0.88 GAA (0.30) POLBGAA
SCHEMBL29487238 0.88 GAA (0.30) POLBGAA
SCHEMBL3505602 0.88 GAA (0.30) POLBGAA
SCHEMBL17336913 0.88 GAA (0.30) POLBGAA
SCHEMBL15248864 0.86 POLB (0.35) POLBGAA
SCHEMBL112485 0.83 POLB (0.41) POLBGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4338761-A1 PERFUMING COMPOSITIONS Firmenich SA (CH) 2024-03-20 EP disclosed