SCHEMBL19863261

SCHEMBL19863261

CC(C)(C)C(=O)OCC(F)(F)S(=O)(=O)OC(C(=O)c1ccccc1)C(F)(F)F

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELANE P08246 4/20 0.35
PRSS1 P07477 4/20 0.33
CTSG P08311 4/20 0.33
CTRB1 P17538 4/20 0.33
CMA1 P23946 4/20 0.33
POLB P06746 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
AAK1 Q2M2I8 1/20 0.33
MAPK1 P28482 1/20 0.33
HIF1A Q16665 1/20 0.33
CA12 O43570 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA9 Q16790 1/20 0.32
PRKCA P17252 1/20 0.32
PRKCD Q05655 1/20 0.32
NPC1 O15118 1/20 0.32
HTR1A P08908 1/20 0.32
CYP2D6 P10635 1/20 0.32
SCN1A P35498 1/20 0.32

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
SCHEMBL19862653 0.84 ELANE (0.35) ELANEPOLBNPSR1AAK1MAPK1
SCHEMBL19863277 0.77 ALDH1A1 (0.39) ELANECTRB1POLBMAPK1NPC1
SCHEMBL19863256 0.76 SRC (0.41) ELANEPRSS1CTSGCTRB1CMA1
SCHEMBL501907 0.74 HSD11B1 (0.40) ELANEPOLBNPSR1MAPK1NPC1
SCHEMBL27459557 0.71 CES1 (0.38) NPSR1TDP1MAPT
SCHEMBL19866621 0.69 HDAC8 (0.38) POLBNPSR1CA12CA1CA2
SCHEMBL7630497 0.68 CES1 (0.44) POLBNPC1TDP1MAPTHTT
SCHEMBL501701 0.68 ALDH1A1 (0.41) POLBMAPK1NPC1CYP2D6MAPT
SCHEMBL501906 0.68 KMT2A (0.36) ELANEPOLBNPSR1MAPK1HIF1A
SCHEMBL12938425 0.67 MAPK1 (0.56) ELANEMAPK1HIF1ANPC1HTR1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9983475-B2 Fluorinated sulfonate esters of aryl ketones for non-ionic photo-acid generators INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2018-05-29 US disclosed
US-9983475-B2 Fluorinated sulfonate esters of aryl ketones for non-ionic photo-acid generators INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2018-05-29 US disclosed
US-20180046077-A1 FLUORINATED SULFONATE ESTERS OF ARYL KETONES FOR NON-IONIC PHOTO-ACID GENERATORS INTERNATIONAL BUSINESS MACHINES CORPORATION 2018-02-15 US disclosed
US-20180046077-A1 FLUORINATED SULFONATE ESTERS OF ARYL KETONES FOR NON-IONIC PHOTO-ACID GENERATORS INTERNATIONAL BUSINESS MACHINES CORPORATION 2018-02-15 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-20180046077-A1 FLUORINATED SULFONATE ESTERS OF ARYL KETONES FOR NON-IONIC PHOTO-ACID GENERATORS PFAS, PLG, PPARG ELANE 2384/4885PRSS1 855/4885CTSG 431/4885

“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.