SCHEMBL18290294

SCHEMBL18290294

CC(C)c1cc2c(cc1O)[C@@]1(C)CCC[C@@]3(C)CO[C@H](C31)C2(O)O

nearest known ligand 0.43

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ SOD1 P00441 1/20 0.43
▸ KARS1 Q15046 1/20 0.42
▸ FDPS P14324 1/20 0.32

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
SCHEMBL18290302 0.76 SOD1 (0.47) SOD1KARS1FDPS
SCHEMBL18290209 0.64 KARS1 (0.50) SOD1KARS1FDPS
SCHEMBL18290243 0.64 SOD1 (0.45) SOD1KARS1FDPS
SCHEMBL8014515 0.63 RXRA (0.49) SOD1KARS1
SCHEMBL18290200 0.63 SOD1 (0.76) SOD1KARS1FDPS
SCHEMBL18290199 0.62 KARS1 (0.40) SOD1KARS1FDPS
Sugiol SCHEMBL17407685 0.61 SOD1 (0.58) SOD1KARS1FDPS
Sugiol SCHEMBL28605319 0.61 SOD1 (0.58) SOD1KARS1FDPS
Sugiol SCHEMBL1086916 0.61 SOD1 (0.58) SOD1KARS1FDPS
SCHEMBL29934307 0.61 KARS1 (0.65) SOD1KARS1FDPS

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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