SCHEMBL14035564

SCHEMBL14035564

CC(OC(C)(C)C)C(=O)C(C)(C)C(C)(C)OC(CC(=O)Nc1ccc(S(=O)(=O)O)cc1)C(=O)C(C)(C)C

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CA1 P00915 4/20 0.39
CA2 P00918 4/20 0.39
CA7 P43166 2/20 0.39
CA14 Q9ULX7 2/20 0.39
ALDH1A1 P00352 5/20 0.36
LMNA P02545 2/20 0.36
SCN3A Q9NY46 1/20 0.36
PTPN1 P18031 1/20 0.35
TP53 P04637 1/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
ATM Q13315 1/20 0.34
MAPT P10636 1/20 0.34
POLB P06746 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
SCHEMBL14273521 0.88 CASR (0.41) CA1CA2ALDH1A1LMNASMN1; SMN2
SCHEMBL13768015 0.82 CA1 (0.37) CA1CA2ALDH1A1SMN1; SMN2POLB
SCHEMBL13513688 0.82 CA1 (0.35) CA1CA2CA7CA14ALDH1A1
SCHEMBL13767997 0.79 CD40 (0.39)
SCHEMBL13844133 0.79 ALDH1A1 (0.36) CA1CA2ALDH1A1LMNATP53
SCHEMBL13768301 0.73 KDM4E (0.36) CA1CA2ALDH1A1POLB
SCHEMBL13844226 0.72 KMT2A (0.33) ALDH1A1LMNAMAPT
SCHEMBL13767938 0.71 ALDH1A1 (0.35) CA1CA2ALDH1A1
SCHEMBL13764190 0.70 SCN3A (0.44) CA1CA2CA7CA14ALDH1A1
SCHEMBL13844187 0.70 HDAC3 (0.36) ALDH1A1

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
EP-1774410-B1 CHARGE CONTROL AGENT, TONER, IMAGE FORMING METHOD, AND IMAGE FORMING APPARATUS CANON KK (JP) 2008-11-19 EP 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 CA1 1473/4885CA2 1054/4885CA7 345/4885

“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.