SCHEMBL30879573

SCHEMBL30879573

CC1=C[C@@H](C)[C@@]2(CCCC(C)(C)C2=O)CC1

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
LIG1 P18858 1/20 0.31

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
SCHEMBL5200075 1.00 LIG1 (0.31) LIG1
SCHEMBL22614840 1.00 LIG1 (0.31) LIG1
SCHEMBL21001032 0.85 LIG1 (0.32) LIG1
SCHEMBL5199663 0.78
SCHEMBL5201025 0.77
SCHEMBL5199259 0.72 LIG1 (0.32) LIG1
SCHEMBL24475286 0.71 CYP3A4 (0.33) LIG1
SCHEMBL5200872 0.71 CYP3A4 (0.33) LIG1
SCHEMBL21001389 0.70 LIG1 (0.33) LIG1
SCHEMBL5202819 0.70 LIG1 (0.30) LIG1

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