SCHEMBL21135960

SCHEMBL21135960

CC(F)(C1CCCCC1)S(=O)(=O)O

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PDK1 Q15118 1/20 0.35
PDK2 Q15119 1/20 0.35
PDK3 Q15120 1/20 0.35
PDK4 Q16654 1/20 0.35
EPHX1 P07099 1/20 0.32
SSTR4 P31391 1/20 0.32
ALDH1A1 P00352 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL21135703 0.98 PDK1 (0.32) PDK1PDK2PDK3PDK4ALDH1A1
SCHEMBL12307785 0.79 PDK1 (0.33) PDK1PDK2PDK3PDK4EPHX1
SCHEMBL10603275 0.78 CA1 (0.36) PDK1PDK2PDK3PDK4
SCHEMBL21136020 0.77 CA1 (0.33) ALDH1A1L3MBTL1
SCHEMBL1049323 0.77 SSTR4 (0.37) EPHX1SSTR4
SCHEMBL3874080 0.77 ALDH1A1 (0.32) ALDH1A1L3MBTL1
SCHEMBL21136022 0.75 ADH1B (0.31) PDK1PDK2PDK3PDK4
SCHEMBL3870823 0.75 ALDH1A1 (0.33) ALDH1A1L3MBTL1
SCHEMBL3873350 0.74 ALDH1A1 (0.30) ALDH1A1L3MBTL1
SCHEMBL5805459 0.74 EPHX1 (0.32) EPHX1SSTR4ALDH1A1

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 PDK1 4885/4885PDK2 4742/4885PDK3 4858/4885

“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.