SCHEMBL21136014

SCHEMBL21136014

CCCC(C)(C(F)(F)F)S(=O)(=O)O

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CES1 P23141 4/20 0.32
EPHX1 P07099 1/20 0.31
ALDH1A1 P00352 1/20 0.31
L3MBTL1 Q9Y468 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
SCHEMBL6906998 0.76 FDPS (0.36) CES1EPHX1ALDH1A1L3MBTL1
SCHEMBL3874301 0.74 CES1 (0.33) CES1EPHX1ALDH1A1L3MBTL1
SCHEMBL3871127 0.73 LPAR1 (0.35) CES1EPHX1ALDH1A1L3MBTL1
Sulfuric Acid SCHEMBL5488887 0.71 CES1 (0.34) CES1EPHX1
Ammonia Solution, Strong SCHEMBL18008280 0.71 LPAR1 (0.34) CES1EPHX1ALDH1A1L3MBTL1
SCHEMBL6018675 0.70 FDPS (0.33) ALDH1A1
Sulfuric Acid SCHEMBL5490610 0.70 CES1 (0.33) CES1EPHX1
SCHEMBL15702986 0.70 EPHX1 (0.32) EPHX1ALDH1A1L3MBTL1
SCHEMBL16348874 0.70 ALDH1A1 (0.32) ALDH1A1L3MBTL1
Trifluoromethanesulfonic Acid SCHEMBL3361058 0.69 EPHX1 (0.43) CES1EPHX1ALDH1A1L3MBTL1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190196326-A1 ACTINIC RAY-SENSITIVE OR RADIATION-SENSITIVE RESIN COMPOSITION, RESIST FILM, PATTERN FORMING METHOD, AND METHOD OF MANUFACTURING ELECTRONIC DEVICE FUJIFILM CORPORATION (JP) 2019-06-27 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-20190196326-A1 ACTINIC RAY-SENSITIVE OR RADIATION-SENSITIVE RESIN COMPOSITION, RESIST FILM, PATTERN FORMING METHOD, AND METHOD OF MANUFACTURING ELECTRONIC DEVICE RER1, ACTR5, RAD51 CES1 1746/4885EPHX1 139/4885ALDH1A1 1556/4885

“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.