SCHEMBL13764186

SCHEMBL13764186

COC(C)C(=O)OC(CCCC(=O)Nc1ccccc1S(=O)(=O)O)C(C)=O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 1/20 0.38
HDAC2 Q92769 4/20 0.36
HDAC3 O15379 3/20 0.36
HDAC1 Q13547 3/20 0.36
HDAC4 P56524 2/20 0.36
HDAC7 Q8WUI4 2/20 0.36
HDAC10 Q969S8 2/20 0.36
HDAC11 Q96DB2 2/20 0.36
HDAC8 Q9BY41 2/20 0.36
HDAC6 Q9UBN7 2/20 0.36
HDAC9 Q9UKV0 2/20 0.36
HDAC5 Q9UQL6 2/20 0.36
CA1 P00915 2/20 0.35
CA2 P00918 2/20 0.35
TSHR P16473 2/20 0.35
ALDH1A1 P00352 2/20 0.35
KDM4E B2RXH2 1/20 0.35
HSD17B10 Q99714 1/20 0.35
PTPRC P08575 1/20 0.34
PTPN13 Q12923 1/20 0.34

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
SCHEMBL13764187 0.97 HDAC2 (0.40) RAB9AHDAC2HDAC3HDAC1HDAC4
SCHEMBL12141386 0.96 HDAC2 (0.41) RAB9AHDAC2HDAC3HDAC1HDAC4
SCHEMBL12141371 0.94 CA1 (0.36) RAB9AHDAC2HDAC3HDAC1HDAC4
SCHEMBL13764189 0.87 CA1 (0.38) CA1CA2TSHRALDH1A1KDM4E
SCHEMBL13764198 0.87 HDAC2 (0.40) RAB9AHDAC2HDAC3HDAC1HDAC4
SCHEMBL12141375 0.84 CA1 (0.36) RAB9AHDAC2HDAC3HDAC1HDAC4
SCHEMBL13764223 0.82 CA1 (0.34) RAB9AHDAC2HDAC3HDAC1HDAC4
SCHEMBL13995241 0.81 HDAC3 (0.40) HDAC2HDAC3HDAC1HDAC4HDAC7
SCHEMBL13798037 0.81 HDAC3 (0.38) RAB9AHDAC2HDAC3HDAC1HDAC4
SCHEMBL13764199 0.78 CA1 (0.37) CA1CA2TSHRALDH1A1KDM4E

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 RAB9A 4255/4885HDAC2 3127/4885HDAC3 3053/4885

“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.