SCHEMBL25529111

SCHEMBL25529111

CC(=O)c1c(C)n(C)c(C)cc1=O

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.44
POLB P06746 1/20 0.41
HTT P42858 1/20 0.41
LMNA P02545 1/20 0.39
ALDH1A1 P00352 3/20 0.38
TSHR P16473 1/20 0.36
MEN1 O00255 1/20 0.34
CYP3A4 P08684 1/20 0.34
HPGD P15428 1/20 0.34
KMT2A Q03164 1/20 0.34
THRB P10828 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
MAPK1 P28482 2/20 0.33
GAA P10253 2/20 0.33
TYR P14679 1/20 0.33

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
SCHEMBL11389408 0.84 ALDH1A1 (0.45) POLBLMNAALDH1A1MEN1CYP3A4
SCHEMBL29868078 0.82 MAPT (0.38) KDM4EPOLBLMNAALDH1A1KMT2A
SCHEMBL29868349 0.82 ALDH1A1 (0.33) KDM4EPOLBHTTALDH1A1GAA
SCHEMBL25533294 0.79 KDM4E (0.53) KDM4EALDH1A1MEN1CYP3A4HPGD
SCHEMBL25529274 0.78 TYR (0.37) KDM4EPOLBHTTALDH1A1TSHR
SCHEMBL20026452 0.72 KDM4E (0.47) KDM4EHTTALDH1A1HPGDGAA
SCHEMBL16672604 0.72 MAPT (0.38) KDM4EPOLBLMNAALDH1A1MEN1
SCHEMBL2280549 0.71 L3MBTL1 (0.54) KDM4EPOLBHTTALDH1A1TSHR
SCHEMBL2540404 0.68 MAPT (0.38) KDM4EPOLBALDH1A1MEN1CYP3A4
SCHEMBL29868351 0.68 MAPT (0.36) KDM4EPOLBLMNAALDH1A1MEN1

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
US-20230151003-A1 COMPOUNDS AND METHODS OF USE EXELIXIS INC (US) 2023-05-18 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-20230151003-A1 COMPOUNDS AND METHODS OF USE PRKACB, PRKACA, PRKX KDM4E 3309/4885POLB 1012/4885HTT 1724/4885

“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.