SCHEMBL25529274

SCHEMBL25529274

CCc1c(C(C)=O)c(=O)cc(C)n1C

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TYR P14679 2/20 0.37
ALDH1A1 P00352 4/20 0.34
KDM4E B2RXH2 2/20 0.34
HSD17B10 Q99714 2/20 0.34
GAA P10253 1/20 0.34
HPGD P15428 1/20 0.34
TSHR P16473 1/20 0.33
MMP1 P03956 1/20 0.32
MMP7 P09237 1/20 0.32
MMP9 P14780 1/20 0.32
MMP8 P22894 1/20 0.32
MMP13 P45452 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.31
POLB P06746 1/20 0.31
HTT P42858 1/20 0.31
CA12 O43570 1/20 0.31

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
SCHEMBL25536924 0.82 KDM4E (0.40) TYRALDH1A1KDM4EHSD17B10HPGD
SCHEMBL25529111 0.78 KDM4E (0.44) TYRALDH1A1KDM4EGAAHPGD
SCHEMBL25529270 0.68 KDM4E (0.35) KDM4EHSD17B10GAATSHR
SCHEMBL11389408 0.67 ALDH1A1 (0.45) ALDH1A1MMP1MMP7MMP9MMP8
SCHEMBL29868078 0.66 MAPT (0.38) TYRALDH1A1KDM4EHSD17B10GAA
SCHEMBL29868349 0.66 ALDH1A1 (0.33) TYRALDH1A1KDM4EGAAPOLB
SCHEMBL2280549 0.66 L3MBTL1 (0.54) ALDH1A1KDM4EGAAHPGDTSHR
SCHEMBL7554482 0.66 MMP1 (0.40) TYRKDM4EMMP1MMP7MMP9
SCHEMBL23732184 0.66 KDM4E (0.50) ALDH1A1KDM4EHSD17B10GAAHPGD
SCHEMBL23147400 0.65 ALDH1A1 (0.44) ALDH1A1KDM4EHSD17B10GAAHPGD

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 TYR 1198/4885ALDH1A1 3998/4885KDM4E 3309/4885

“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.