SCHEMBL4226833

SCHEMBL4226833

C=C(C)[C@@H](CC=C(C)C)C[C@@]12C[C@@H](CC=C(C)C)C(C)(C)[C@@](CC=C(C)C)(C(=O)C(C(=O)c3ccc(O)c(O)c3)=C1OC(=O)CC(O)(C(=O)O)C(O)C(=O)O)C2=O

nearest known ligand 0.61

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
EP300 Q09472 9/20 0.61
HDAC11 Q96DB2 2/20 0.61
KAT2B Q92831 2/20 0.61
PTGES O14684 1/20 0.61
HDAC8 Q9BY41 1/20 0.61
POLL Q9UGP5 7/20 0.40
STAT1 P42224 1/20 0.40
MET P08581 3/20 0.38
SIRT1 Q96EB6 3/20 0.37
SIRT2 Q8IXJ6 2/20 0.37

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
SCHEMBL4229280 0.86 EP300 (0.65) EP300HDAC11KAT2BPTGESHDAC8
Guttiferone F SCHEMBL19565392 0.83 EP300 (0.75) EP300HDAC11KAT2BPTGESHDAC8
Guttiferone F SCHEMBL4607088 0.83 EP300 (0.75) EP300HDAC11KAT2BPTGESHDAC8
Garcinol SCHEMBL294532 0.83 EP300 (0.75) EP300HDAC11KAT2BPTGESHDAC8
Guttiferone F SCHEMBL23815758 0.83 EP300 (0.75) EP300HDAC11KAT2BPTGESHDAC8
Guttiferone F SCHEMBL25049796 0.83 EP300 (0.75) EP300HDAC11KAT2BPTGESHDAC8
Guttiferone F SCHEMBL23607580 0.83 EP300 (0.75) EP300HDAC11KAT2BPTGESHDAC8
Guttiferone F SCHEMBL23815733 0.83 EP300 (0.75) EP300HDAC11KAT2BPTGESHDAC8
Guttiferone F SCHEMBL23815760 0.83 EP300 (0.75) EP300HDAC11KAT2BPTGESHDAC8
Guttiferone F SCHEMBL31345886 0.83 EP300 (0.75) EP300HDAC11KAT2BPTGESHDAC8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090042846-A1 Topical Delivery System for Phytosterols BIODERM RESEARCH (US) 2009-02-12 US claimed
US-7615546-B2 Skin disorders; acne; alopecia BIODERM RESEARCH (US) 2009-11-10 US disclosed
US-20090042846-A1 Topical Delivery System for Phytosterols BIODERM RESEARCH (US) 2009-02-12 US 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-20090042846-A1 Topical Delivery System for Phytosterols COL14A1, CYP27A1, CYP46A1 EP300 249/4885HDAC11 1355/4885KAT2B 702/4885

“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.