SCHEMBL15944489

SCHEMBL15944489

CCOC(=O)C(CC)C(=O)NC

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP8 P22894 2/20 0.41
GAA P10253 3/20 0.41
MGAM O43451 1/20 0.41
SI P14410 1/20 0.41
MGAM2 Q2M2H8 1/20 0.41
ALDH1A1 P00352 5/20 0.39
RAB9A P51151 1/20 0.38
LMNA P02545 1/20 0.37
HSD17B10 Q99714 1/20 0.37
HPGD P15428 1/20 0.37
RECQL P46063 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
TP53 P04637 1/20 0.37
KDM4E B2RXH2 2/20 0.36
MAPT P10636 2/20 0.36
HTT P42858 1/20 0.36
NPY1R P25929 1/20 0.36
NPY2R P49146 1/20 0.36
ALOX15 P16050 1/20 0.36
SOAT1 P35610 1/20 0.36

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
Dimethylamine SCHEMBL15710606 0.84 GAA (0.46) MMP8GAAMGAMSIMGAM2
SCHEMBL230068 0.81 ALDH1A1 (0.50) MMP8GAAMGAMSIMGAM2
SCHEMBL13105113 0.81 MEN1 (0.41) MMP8GAAALDH1A1LMNAHTT
SCHEMBL15944492 0.80 CA1 (0.43) MMP8ALDH1A1MEN1KMT2ATDP1
SCHEMBL3673028 0.79 MMP8 (0.39) MMP8GAAMGAMSIMGAM2
SCHEMBL5247619 0.79 GAA (0.41) MMP8GAAMGAMSIMGAM2
SCHEMBL11850927 0.79 GAA (0.34) MMP8GAAMGAMSIMGAM2
SCHEMBL11850908 0.79 GAA (0.34) MMP8GAAMGAMSIMGAM2
Hydrochloric Acid SCHEMBL27522636 0.79 ALDH1A1 (0.48) MMP8GAAMGAMSIMGAM2
Ammonia Solution, Strong SCHEMBL27830684 0.79 ALDH1A1 (0.48) MMP8GAAMGAMSIMGAM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9056817-B2 Arylated β-dicarbonyl compounds and process for the preparation thereof COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2015-06-16 US disclosed
US-20140228592-A1 ARYLATED BETA-DICARBONYL COMPOUNDS AND PROCESS FOR THE PREPARATION THEREOF COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2014-08-14 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-20140228592-A1 ARYLATED BETA-DICARBONYL COMPOUNDS AND PROCESS FOR THE PREPARATION THEREOF CYP51A1, DDT, CYP3A4 MMP8 4860/4885GAA 814/4885MGAM 53/4885

“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.