SCHEMBL14215470

SCHEMBL14215470

CCC(NS(=O)(=O)C(C)C)C(=O)O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.35
FOLH1 Q04609 2/20 0.35
NAALAD2 Q9Y3Q0 2/20 0.35
GRIA1 P42261 3/20 0.34
TGFBR1 P36897 2/20 0.33
MEN1 O00255 1/20 0.33
LMNA P02545 1/20 0.33
KMT2A Q03164 1/20 0.33
ACE P12821 1/20 0.33
MME P08473 1/20 0.33
GCLC P48506 1/20 0.33
KDM4E B2RXH2 1/20 0.33
CYP2C19 P33261 1/20 0.33
MMP1 P03956 1/20 0.33
MMP2 P08253 1/20 0.33
MMP3 P08254 1/20 0.33
MMP7 P09237 1/20 0.33
MMP9 P14780 1/20 0.33
MMP13 P45452 1/20 0.33
POLB P06746 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
SCHEMBL7378230 0.82 GABRR1 (0.34) ALDH1A1FOLH1NAALAD2GRIA1TGFBR1
SCHEMBL6976447 0.82 GABRR1 (0.34) ALDH1A1FOLH1NAALAD2GRIA1TGFBR1
SCHEMBL5514483 0.82 ALDH1A1 (0.52) ALDH1A1FOLH1MEN1LMNAKMT2A
SCHEMBL24108521 0.78 ITGB3 (0.39) ALDH1A1FOLH1NAALAD2TGFBR1KDM4E
SCHEMBL10076157 0.78 ITGB3 (0.39) ALDH1A1FOLH1NAALAD2TGFBR1KDM4E
SCHEMBL28243176 0.73 ALDH1A1 (0.34) ALDH1A1TGFBR1KDM4ECYP2C19MMP1
SCHEMBL7298468 0.73 MMP2 (0.60) ALDH1A1LMNAACEMMEMMP1
Trifluoroacetic Acid SCHEMBL7661149 0.73 CA1 (0.34) ALDH1A1MMP1MMP2MMP9MMP13
SCHEMBL17323656 0.73 MMP2 (0.60) ALDH1A1LMNAACEMMEMMP1
SCHEMBL19901362 0.72 ECE1 (0.41) GRIA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1806342-B1 3-CARBAMOYL-2-PYRIDONE DERIVATIVE SHIONOGI & CO (JP) 2013-04-17 EP disclosed
US-20080103139-A1 3-Carbamoyl-2-Pyridone Derivative SHIONOGI & CO. LTD. (JP) 2008-05-01 US disclosed
EP-1806342-A1 3-CARBAMOYL-2-PYRIDONE DERIVATIVE SHIONOGI & CO., LTD. (JP) 2007-07-11 EP 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-20080103139-A1 3-Carbamoyl-2-Pyridone Derivative CNR1, CNR2, HRH4 ALDH1A1 4132/4885FOLH1 4169/4885NAALAD2 2580/4885

“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.