SCHEMBL31376280

SCHEMBL31376280

CC(=O)OC[C@@]1(C)[C@@H]2C[C@H](OC(C)=O)[C@@]3(C)Oc4cc(-c5cccnc5)oc(=O)c4[C@H](O)[C@@H]3[C@@]2(C)CC[C@@H]1OC(C)=O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SOAT2 O75908 14/20 1.00
SOAT1 P35610 13/20 1.00

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
SCHEMBL21003882 1.00 SOAT2 (1.00) SOAT2SOAT1
SCHEMBL19149738 1.00 SOAT2 (1.00) SOAT2SOAT1
SCHEMBL15894812 1.00 SOAT2 (1.00) SOAT2SOAT1
SCHEMBL12315986 1.00 SOAT2 (1.00) SOAT2SOAT1
SCHEMBL12467707 1.00 SOAT2 (1.00) SOAT2SOAT1
SCHEMBL12654001 1.00 SOAT2 (1.00) SOAT2SOAT1
SCHEMBL18648382 1.00 SOAT2 (1.00) SOAT2SOAT1
SCHEMBL106356 1.00 SOAT2 (1.00) SOAT2SOAT1
SCHEMBL12467442 0.96 SOAT2 (0.92) SOAT2SOAT1
SCHEMBL12467763 0.95 SOAT2 (1.00) SOAT2SOAT1

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
CN-119504775-A Extraction method and application of aza sesquiterpenoids 中国科学院南海海洋研究所 2025-02-25 CN disclosed