SCHEMBL25529108

SCHEMBL25529108

CC(=O)c1c(C)n(C)c(C)c(Br)c1=O

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.48
LMNA P02545 3/20 0.39
POLB P06746 1/20 0.34
HTT P42858 1/20 0.34
TSHR P16473 2/20 0.33
IKBKB O14920 1/20 0.32
MAP3K14 Q99558 1/20 0.32
KMT2A Q03164 3/20 0.31
MEN1 O00255 2/20 0.31
ALDH1A1 P00352 2/20 0.31
THRB P10828 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.30
PABPC1 P11940 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL25529107 0.84 KMT2A (0.40) KDM4EKMT2AMEN1L3MBTL1
SCHEMBL25529270 0.80 KDM4E (0.35) KDM4ETSHRKMT2AMEN1
SCHEMBL25533295 0.79 KDM4E (0.58) KDM4ELMNAKMT2AMEN1ALDH1A1
SCHEMBL26967883 0.77 KMT2A (0.54) KDM4ETSHRKMT2AALDH1A1L3MBTL1
SCHEMBL22870151 0.71 KDM4E (0.47) KDM4ELMNAPOLBHTTTSHR
SCHEMBL7477443 0.70 KDM4E (0.61) KDM4ELMNAPOLBHTTTSHR
SCHEMBL25529268 0.69 USP2 (0.34) TSHRKMT2AMEN1L3MBTL1
SCHEMBL26967907 0.67 KDM4E (0.42) KDM4ELMNAPOLBKMT2AMEN1
SCHEMBL474758 0.67 KDM4E (0.47) KDM4ELMNAPOLBHTTTSHR
SCHEMBL29868162 0.66 POLB (0.41) KDM4ELMNAPOLBKMT2AALDH1A1

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 3309/4885LMNA 2600/4885POLB 1012/4885

“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.