SCHEMBL13446138

SCHEMBL13446138

CCCCOCOC(=O)C(F)(F)C(F)(F)C(=O)OCOCCCC

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CES2 O00748 4/20 0.46
ALDH1A1 P00352 1/20 0.42
FAAH O00519 8/20 0.39
ATM Q13315 1/20 0.39
TSHR P16473 1/20 0.39
CES1 P23141 6/20 0.38
MEN1 O00255 1/20 0.38
CYP1A2 P05177 1/20 0.38
KMT2A Q03164 1/20 0.38
HSD17B10 Q99714 1/20 0.38

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
SCHEMBL13446145 0.94 CES2 (0.53) CES2FAAHCES1MEN1CYP1A2
SCHEMBL12346013 0.93 ALDH1A1 (0.41) CES2ALDH1A1FAAHATMTSHR
SCHEMBL13446139 0.93 CES2 (0.56) CES2FAAHCES1MEN1CYP1A2
SCHEMBL13446144 0.88 CES2 (0.36) CES2ALDH1A1FAAHTSHRCES1
SCHEMBL12346014 0.88 CES2 (0.47) CES2ALDH1A1FAAHTSHRCES1
SCHEMBL12346017 0.87 CES2 (0.50) CES2FAAHTSHRCES1MEN1
SCHEMBL12346016 0.81 CES2 (0.33) CES2ALDH1A1TSHR
SCHEMBL13446143 0.79 ALDH1A1 (0.37) CES2ALDH1A1FAAHTSHRCES1
SCHEMBL13554495 0.79 ALDH1A1 (0.41) CES2ALDH1A1ATMTSHR
SCHEMBL28342787 0.78 NAAA (0.52) CES2ALDH1A1FAAHATMTSHR

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-8476473-B2 Compound, method for preparing the compound and resist composition containing the compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2013-07-02 US disclosed
US-20100055609-A1 COMPOUND, METHOD FOR PREPARING THE COMPOUND AND RESIST COMPOSITION CONTAINING THE COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-03-04 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-20100055609-A1 COMPOUND, METHOD FOR PREPARING THE COMPOUND AND RESIST COMPOSITION CONTAINING THE COMPOUND AFF1, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, AFF4 CES2 1611/4885ALDH1A1 3688/4885FAAH 81/4885

“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.