SCHEMBL23879802

SCHEMBL23879802

CC(C)C(=O)c1occc(=O)c1O

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.50
LMNA P02545 1/20 0.50
MMP1 P03956 1/20 0.41
MMP3 P08254 1/20 0.41
MMP7 P09237 1/20 0.41
MMP9 P14780 1/20 0.41
MMP8 P22894 1/20 0.41
MMP12 P39900 1/20 0.41
MMP13 P45452 1/20 0.41
FFAR1 O14842 1/20 0.41
APP P05067 4/20 0.39
DBH P09172 1/20 0.35
GAA P10253 1/20 0.35
RECQL P46063 1/20 0.35
PTGES O14684 2/20 0.33
ALOX5 P09917 2/20 0.33
MAPK1 P28482 1/20 0.33
FTO Q9C0B1 1/20 0.33
ALDH1A1 P00352 1/20 0.31
MAPT P10636 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
SCHEMBL25332706 0.79 KDM4E (0.55) KDM4ELMNAMMP1MMP3MMP7
SCHEMBL289813 0.76 KDM4E (0.52) KDM4ELMNAMMP1MMP3MMP7
SCHEMBL13689302 0.75 KDM4E (0.49) KDM4EFFAR1DBHGAARECQL
SCHEMBL13947098 0.75 KDM4E (0.50) KDM4ELMNAMMP1MMP3MMP7
SCHEMBL23879785 0.74 KDM4E (0.50) KDM4ELMNAMMP1MMP3MMP7
SCHEMBL23879799 0.74 KDM4E (0.50) KDM4ELMNAMMP1MMP3MMP7
SCHEMBL3308377 0.74 MMP3 (0.51) KDM4ELMNAMMP1MMP3MMP7
SCHEMBL356631 0.73 KDM4E (0.48) KDM4ELMNAMMP1MMP3MMP7
SCHEMBL15287180 0.73 KDM4E (0.48) KDM4ELMNAMMP1MMP3MMP7
SCHEMBL146966 0.73 KDM4E (0.48) KDM4ELMNAMMP1MMP3MMP7

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-11136251-B2 Compositions, methods, and devices for capturing phosphate from water REGENTS OF THE UNIVERSITY OF MINNESOTA (US) 2021-10-05 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-11136251-B2 Compositions, methods, and devices for capturing phosphate from water PPA1, ACP3, CASR KDM4E 2964/4885LMNA 3172/4885MMP1 3255/4885

“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.