SCHEMBL13764196

SCHEMBL13764196

COC(C)C(=O)OC(CC(=O)Nc1cccc2cccc(S(=O)(=O)O)c12)C(C)=O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CD40 P25942 3/20 0.43
CD40LG P29965 3/20 0.43
TTR P02766 1/20 0.40
FABP4 P15090 1/20 0.40
CCNA2 P20248 1/20 0.40
CDK2 P24941 1/20 0.40
MAPK14 Q16539 1/20 0.40
NR4A1 P22736 1/20 0.39
CASP6 P55212 1/20 0.33
CYP1A2 P05177 2/20 0.32
CYP2C19 P33261 2/20 0.32
ALDH1A1 P00352 3/20 0.32
GAA P10253 1/20 0.32
POLB P06746 1/20 0.31
SLC40A1 Q9NP59 1/20 0.31
KDM4E B2RXH2 1/20 0.31
HSD17B10 Q99714 1/20 0.31
SMN1; SMN2 Q16637 3/20 0.30
MEN1 O00255 1/20 0.30
LMNA P02545 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
SCHEMBL13764189 0.89 CA1 (0.38) ALDH1A1GAAPOLBKDM4EHSD17B10
SCHEMBL13764199 0.81 CA1 (0.37) ALDH1A1GAAPOLBKDM4EHSD17B10
SCHEMBL13798036 0.81 CD40 (0.46) CD40CD40LGTTRFABP4CCNA2
SCHEMBL12141395 0.80 HTT (0.36) CYP1A2CYP2C19ALDH1A1GAAHSD17B10
SCHEMBL12141404 0.79 CYP2C19 (0.35) CYP1A2CYP2C19ALDH1A1GAAPOLB
SCHEMBL13995224 0.79 CD40 (0.41) CD40CD40LGTTRFABP4CCNA2
SCHEMBL13764197 0.79 ALDH1A1 (0.39) ALDH1A1MAPTCA1CA2
SCHEMBL12141371 0.78 CA1 (0.36) ALDH1A1GAAPOLBKDM4EHSD17B10
SCHEMBL13764192 0.78 POLB (0.40) ALDH1A1POLBKDM4EHSD17B10LMNA
SCHEMBL13764186 0.77 RAB9A (0.38) ALDH1A1KDM4EHSD17B10CA1CA2

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-7557176-B2 Polyhydroxyalkanoic acid having vinyl, ester, carboxyl or sulfonic acid group and producing method therefor CANON KABUSHIKI KAISHA (JP) 2009-07-07 US disclosed
US-20080064828-A1 Polyhydroxyalkanoic Acid Having Vinyl, Ester, Carboxyl or Sulfonic Acid Group and Producing Method Therefor CANON KABUSHIKI KAISHA (JP) 2008-03-13 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-20080064828-A1 Polyhydroxyalkanoic Acid Having Vinyl, Ester, Carboxyl or Sulfonic Acid Group and Producing Method Therefor FAR1, ACSL4, ACAD11 CD40 575/4885CD40LG 597/4885TTR 4713/4885

“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.