SCHEMBL18290225

SCHEMBL18290225

CC(C)c1cc2c(cc1O)[C@@]13CCC(=O)C(C)(C)C1[C@@H](Oc1cc4c(cc1C(C)C)C=CC1C(C)(C)CCC[C@]41C)[C@@H]2OC3

nearest known ligand 0.34

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ FDPS P14324 1/20 0.32
▸ SOD1 P00441 1/20 0.31
▸ KARS1 Q15046 1/20 0.30

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
SCHEMBL18290223 0.75 SOD1 (0.34) FDPSSOD1KARS1
SCHEMBL16006769 0.74 KARS1 (0.43) FDPSSOD1KARS1
SCHEMBL18290220 0.72 SOD1 (0.33) SOD1KARS1
SCHEMBL18290199 0.67 KARS1 (0.40) FDPSSOD1KARS1
SCHEMBL18290358 0.64 — —
SCHEMBL18290211 0.63 SOD1 (0.53) FDPSSOD1KARS1
SCHEMBL18290371 0.62 — —
SCHEMBL18290245 0.61 LPAR1 (0.32) —
SCHEMBL18290286 0.60 — —
SCHEMBL18290235 0.59 SOD1 (0.38) SOD1KARS1

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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