SCHEMBL18290219

SCHEMBL18290219

Cc1ccc2cc(C(C)C)c3c(c2c1CCCC(C)(O)CO)[C@H]1c2cc(C(C)C)c(O)cc2[C@@]2(C)CCC[C@](C)(CO)C2[C@H]1O3

nearest known ligand 0.39

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ SOD1 P00441 1/20 0.39

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
SCHEMBL18290218 0.87 SOD1 (0.40) SOD1
SCHEMBL18290232 0.74 — —
SCHEMBL18290233 0.74 — —
SCHEMBL18290230 0.68 SOD1 (0.41) SOD1
SCHEMBL18290202 0.66 LMNA (0.33) —
SCHEMBL18290208 0.57 SOD1 (1.00) SOD1
SCHEMBL18290292 0.57 SOD1 (1.00) SOD1
SCHEMBL18290302 0.55 SOD1 (0.47) SOD1
SCHEMBL18290229 0.55 SOD1 (0.72) SOD1
18-Hydroxyferruginol SCHEMBL18290210 0.54 KARS1 (0.67) SOD1

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
WO-2016192631-A1 ABIETANE-TYPE DITERPENE COMPOUND HAVING LIPID-LOWERING ACTIVITY, METHOD FOR PREPARING SAME, AND USE OF SAME 中国科学院上海药物研究所 2016-12-08 — — WO disclosed
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