SCHEMBL13764286

SCHEMBL13764286

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

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.36
HDAC1 Q13547 7/20 0.33
HDAC2 Q92769 6/20 0.33
HDAC3 O15379 4/20 0.33
HDAC4 P56524 4/20 0.33
HDAC7 Q8WUI4 4/20 0.33
HDAC10 Q969S8 4/20 0.33
HDAC11 Q96DB2 4/20 0.33
HDAC8 Q9BY41 4/20 0.33
HDAC6 Q9UBN7 4/20 0.33
HDAC9 Q9UKV0 4/20 0.33
HDAC5 Q9UQL6 4/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
KDM4E B2RXH2 2/20 0.32
ALDH1A1 P00352 2/20 0.32
HSD17B10 Q99714 2/20 0.32
RAB9A P51151 1/20 0.32
ATM Q13315 1/20 0.31
TSHR P16473 1/20 0.31
LMNA P02545 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
SCHEMBL13764230 0.94 POLB (0.38) POLBL3MBTL1KDM4EALDH1A1HSD17B10
SCHEMBL13764223 0.85 CA1 (0.34) POLBHDAC1HDAC2HDAC3HDAC4
SCHEMBL13764192 0.82 POLB (0.40) POLBKDM4EALDH1A1HSD17B10TSHR
SCHEMBL13995229 0.79 POLB (0.38) POLBL3MBTL1KDM4EALDH1A1HSD17B10
SCHEMBL13993739 0.79 POLB (0.38) POLBL3MBTL1KDM4EALDH1A1HSD17B10
SCHEMBL13764273 0.79 TSHR (0.40) POLBL3MBTL1KDM4EALDH1A1TSHR
SCHEMBL13995223 0.77 HDAC2 (0.42) HDAC1HDAC2HDAC3HDAC4HDAC7
SCHEMBL13844229 0.75 POLB (0.33) POLBHDAC1HDAC2HDAC3HDAC4
SCHEMBL13764198 0.73 HDAC2 (0.40) HDAC1HDAC2HDAC3HDAC4HDAC7
SCHEMBL13764199 0.72 CA1 (0.37) POLBKDM4EALDH1A1HSD17B10TSHR

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 POLB 3440/4885HDAC1 2916/4885HDAC2 3127/4885

“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.