SCHEMBL11973504

SCHEMBL11973504

C[N+](C)(C)CC(CC(=O)[O-])OC(=O)CCCCCCCCCCCCCO

nearest known ligand 0.79

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.79
KMT2A Q03164 5/20 0.79
MAPT P10636 4/20 0.79
SLC25A20 O43772 3/20 0.79
TP53 P04637 3/20 0.79
TSHR P16473 3/20 0.79
CYP2D6 P10635 2/20 0.79
SLC6A5 Q9Y345 2/20 0.79
CYP2C19 P33261 2/20 0.79
CYP2C9 P11712 2/20 0.79
HIF1A Q16665 2/20 0.79
KDM4E B2RXH2 1/20 0.79
CYP3A4 P08684 1/20 0.79
NFKB1 P19838 1/20 0.79
THPO P40225 1/20 0.79
HSD17B10 Q99714 1/20 0.79
RECQL P46063 1/20 0.63
MAPK1 P28482 4/20 0.59
CYP1A2 P05177 4/20 0.59
GMNN O75496 3/20 0.59

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
SCHEMBL28525260 1.00 MEN1 (0.79) MEN1KMT2AMAPTSLC25A20TP53
SCHEMBL997303 1.00 MEN1 (0.79) MEN1KMT2AMAPTSLC25A20TP53
SCHEMBL995307 1.00 MEN1 (0.79) MEN1KMT2AMAPTSLC25A20TP53
SCHEMBL15050371 1.00 MEN1 (0.79) MEN1KMT2AMAPTSLC25A20TP53
Hydrochloric Acid SCHEMBL28705824 0.99 MEN1 (0.77) MEN1KMT2AMAPTSLC25A20TP53
SCHEMBL14931520 0.98 MEN1 (0.76) MEN1KMT2AMAPTSLC25A20TP53
SCHEMBL787164 0.94 MEN1 (0.74) MEN1KMT2AMAPTSLC25A20TP53
SCHEMBL8593280 0.94 MEN1 (0.74) MEN1KMT2AMAPTSLC25A20TP53
SCHEMBL18075036 0.94 MEN1 (0.88) MEN1KMT2AMAPTSLC25A20TP53
SCHEMBL16344748 0.94 MEN1 (0.88) MEN1KMT2AMAPTSLC25A20TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109632924-B Plasma lipid marker of human macular neovascular diseases and application thereof 上海市第一人民医院 2022-02-08 CN claimed
US-12534439-B2 Xanthohumol derivatives and methods for making and using OREGON STATE UNIVERSITY (US) 2026-01-27 US disclosed
CN-118604350-A Biomarker for diagnosis of age-related macular degeneration, detection kit and application thereof 上海市第一人民医院 2024-09-06 CN disclosed
US-20240142469-A1 METABOLIC BIOMARKERS FOR ASSESSING HEART FAILURE IN A SINGLE VENTRICLE PEDIATRIC SUBJECT THE TRUSTEES OF INDIANA UNIVERSITY 2024-05-02 US disclosed
US-20240051922-A1 XANTHOHUMOL DERIVATIVES AND METHODS FOR MAKING AND USING OREGON STATE UNIVERSITY (US) 2024-02-15 US disclosed
CN-109632924-B Plasma lipid marker of human macular neovascular diseases and application thereof 上海市第一人民医院 2022-02-08 CN disclosed
US-20120214870-A1 METHODS FOR DIAGNOSIS AND TREATMENT OF CHRONIC FATIGUE SYNDROME UNIVERSITY OF SOUTH AUSTRALIA (AU) 2012-08-23 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 (2 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-12534439-B2 Xanthohumol derivatives and methods for making and using MT-CO1, MT-CO2, PC MEN1 3741/4885KMT2A 3257/4885MAPT 3792/4885
US-20240051922-A1 XANTHOHUMOL DERIVATIVES AND METHODS FOR MAKING AND USING XDH, PC, TFB2M MEN1 4237/4885KMT2A 2952/4885MAPT 3357/4885

“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.