SCHEMBL6135673

SCHEMBL6135673

CC(=O)OC1=C(CC=C(C)C)C(=O)[C@@]2(CC=C(C)C)C[C@H](CC=C(C)C)[C@@](C)(CCC=C(C)C)[C@]1(C(=O)C(C)C)C2=O

nearest known ligand 0.72

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SIRT2 Q8IXJ6 2/20 0.72
SIRT1 Q96EB6 2/20 0.72
PTGES O14684 2/20 0.72
SLC6A2 P23975 2/20 0.72
SLC6A4 P31645 2/20 0.72
SLC6A3 Q01959 2/20 0.72
NR1I2 O75469 1/20 0.72
CYP3A4 P08684 1/20 0.72
DLAT P10515 1/20 0.72
MAPT P10636 1/20 0.72
SMN1; SMN2 Q16637 1/20 0.72
ACHE P22303 14/20 0.59
MET P08581 2/20 0.47

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
SCHEMBL14577497 0.88 SIRT2 (0.86) SIRT2SIRT1PTGESSLC6A2SLC6A4
SCHEMBL12634392 0.88 SIRT2 (0.86) SIRT2SIRT1PTGESSLC6A2SLC6A4
SCHEMBL21907266 0.88 SIRT2 (0.86) SIRT2SIRT1PTGESSLC6A2SLC6A4
SCHEMBL98723 0.88 SIRT2 (0.86) SIRT2SIRT1PTGESSLC6A2SLC6A4
SCHEMBL15694967 0.88 SIRT2 (0.86) SIRT2SIRT1PTGESSLC6A2SLC6A4
SCHEMBL14233249 0.88 SIRT2 (0.86) SIRT2SIRT1PTGESSLC6A2SLC6A4
Methoxymethane SCHEMBL7942622 0.87 SIRT2 (0.82) SIRT2SIRT1PTGESSLC6A2SLC6A4
SCHEMBL7624217 0.87 SIRT2 (0.85) SIRT2SIRT1PTGESSLC6A2SLC6A4
SCHEMBL7871338 0.87 SIRT2 (0.85) SIRT2SIRT1PTGESSLC6A2SLC6A4
SCHEMBL6135548 0.86 SIRT2 (0.61) SIRT2SIRT1PTGESSLC6A2SLC6A4

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101933917-A Application of Hyperforin derivant in preparing drugs UNIV ZHONGSHAN 2011-01-05 CN disclosed
EP-1607099-A1 Use of hyperforin derivatives as an antidepressant agent INDENA S.p.A. (IT) 2005-12-21 EP disclosed
EP-1086071-B1 HYPERFORIN DERIVATIVES, THE USE THEREOF AND FORMULATIONS CONTAINING THEM INDENA SPA (IT) 2005-10-19 EP disclosed
US-6656510-B2 Antidepressants INDENA S.P.A. (IT) 2003-12-02 US disclosed
WO-2000054785-A9 STABILIZED BICYCLO[3.3.1]NONENES AND METHODS OF USE SHAMAN PHARMACEUTICALS INC (US) 2001-12-27 WO disclosed
US-20010020040-A1 Hyperforin derivatives, use thereof and formulations containing them INDENA S.P.A. (IT) 2001-09-06 US disclosed
EP-1086071-A1 HYPERFORIN DERIVATIVES, THE USE THEREOF AND FORMULATIONS CONTAINING THEM INDENA S.p.A. (IT) 2001-03-28 EP disclosed
WO-2000054785-A2 STABILIZED BICYCLO[3.3.1]NONENES AND METHODS OF USE SHAMAN PHARMACEUTICALS, INC. (US) 2000-09-21 WO disclosed
WO-2000054760-A2 BICYCLO (3.3.1) NONENES USEFUL FOR THE TREATMENT OF DIABETES AND HYPERTRIGLYCERIDEMIA SHAMAN PHARMACEUTICALS, INC. (US) 2000-09-21 WO disclosed
WO-1999064388-A1 HYPERFORIN DERIVATIVES, THE USE THEREOF AND FORMULATIONS CONTAINING THEM INDENA S.P.A. (IT) 1999-12-16 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20010020040-A1 Hyperforin derivatives, use thereof and formulations containing them CRH, FOS, VIP SIRT2 452/4885SIRT1 231/4885PTGES 3626/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.