SCHEMBL13764273

SCHEMBL13764273

COC(C)C(=O)OC(CC(C)=O)C(=O)Nc1ccccc1S(=O)(=O)Oc1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.40
L3MBTL1 Q9Y468 3/20 0.38
TDP1 Q9NUW8 2/20 0.37
POLB P06746 2/20 0.37
ALDH1A1 P00352 3/20 0.37
MAPK1 P28482 1/20 0.37
HPGD P15428 2/20 0.37
GAA P10253 2/20 0.36
KLK7 P49862 4/20 0.36
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
KDM4E B2RXH2 1/20 0.34
HTT P42858 1/20 0.34
LMNA P02545 2/20 0.33
TYMS P04818 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
SCHEMBL13764192 0.86 POLB (0.40) TSHRTDP1POLBALDH1A1MAPK1
SCHEMBL13764230 0.81 POLB (0.38) TSHRL3MBTL1TDP1POLBALDH1A1
SCHEMBL13993739 0.79 POLB (0.38) L3MBTL1POLBALDH1A1HPGDGAA
SCHEMBL13764286 0.79 POLB (0.36) TSHRL3MBTL1POLBALDH1A1HPGD
SCHEMBL13995229 0.77 POLB (0.38) TSHRL3MBTL1TDP1POLBALDH1A1
SCHEMBL13764199 0.75 CA1 (0.37) TSHRPOLBALDH1A1GAAKMT2A
SCHEMBL12141401 0.72 SCN3A (0.46) ALDH1A1HPGDMEN1KMT2AKDM4E
SCHEMBL13764189 0.72 CA1 (0.38) TSHRPOLBALDH1A1GAAKMT2A
SCHEMBL12141375 0.71 CA1 (0.36) TSHRPOLBALDH1A1MAPK1KMT2A
SCHEMBL13599207 0.71 MMP12 (0.44) POLBCA1CA2

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 TSHR 3734/4885L3MBTL1 3223/4885TDP1 4106/4885

“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.