SCHEMBL18034641

SCHEMBL18034641

CC(CO)C1OC(=O)C=C2[C@@]13O[C@@H]3C1OC(=O)[C@@]3(C)C[C@@H](O)C[C@@]2(C)C13

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ STAT3 P40763 1/20 0.52
▸ JUN P05412 1/20 0.50
▸ NPC1 O15118 1/20 0.31
▸ MITF O75030 1/20 0.31
▸ LMNA P02545 1/20 0.31
▸ NFKB1 P19838 1/20 0.31
▸ HTT P42858 1/20 0.31
▸ RAB9A P51151 1/20 0.31
▸ NFKB2 Q00653 1/20 0.31
▸ RELA Q04206 1/20 0.31
▸ SMN1; SMN2 Q16637 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
SCHEMBL29709891 0.83 JUN (0.52) STAT3JUN
SCHEMBL18034517 0.66 JUN (0.57) STAT3JUN
SCHEMBL18034495 0.61 LMNA (0.60) NPC1MITFLMNANFKB1HTT
SCHEMBL18034509 0.57 LMNA (0.74) NPC1MITFLMNANFKB1HTT
SCHEMBL18034519 0.56 JUN (0.40) STAT3JUN
SCHEMBL7922761 0.55 JUN (0.39) JUNLMNAHTTSMN1; SMN2
SCHEMBL29709940 0.54 JUN (0.78) STAT3JUN
SCHEMBL11989123 0.50 MGAM (0.31) NPC1MITFLMNANFKB1HTT
Loliolide SCHEMBL16057196 0.50 ACHE (0.53) STAT3
SCHEMBL12464454 0.48 HIF1A (0.33) LMNA

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-2016131426-A1 NAGILACTONE COMPOUNDS HAVING ANTILIPEMIC ACTIVITY, PREPARATION METHOD THEREFOR AND USES THEREOF 中国科学院上海药物研究所 2016-08-25 — — WO disclosed
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