SCHEMBL19862676

SCHEMBL19862676

C=Cc1ccc(NC(=O)C(F)(F)S(=O)(=O)OC(C)C(=C)c2ccccc2)cc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDK1 Q15118 5/20 0.37
PDK2 Q15119 5/20 0.37
PDK3 Q15120 5/20 0.37
PDK4 Q16654 5/20 0.37
ABCC9 O60706 3/20 0.37
ABCC8 Q09428 3/20 0.37
KCNJ11 Q14654 3/20 0.37
KCNJ8 Q15842 3/20 0.37
ABCB11 O95342 1/20 0.37
KMT2A Q03164 5/20 0.36
MEN1 O00255 4/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2D6 P10635 1/20 0.36
TSHR P16473 1/20 0.36
CYP2C19 P33261 1/20 0.36
LMNA P02545 4/20 0.34
RAB9A P51151 6/20 0.34
ALDH1A1 P00352 5/20 0.34
RXFP1 Q9HBX9 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
SCHEMBL19862659 0.92 KMT2A (0.39) PDK1PDK2PDK3PDK4ABCC9
SCHEMBL19862669 0.82 PDK1 (0.36) PDK1PDK2PDK3PDK4ABCC9
SCHEMBL19862658 0.77 ABCC9 (0.41) PDK1PDK2PDK3PDK4ABCC9
SCHEMBL12814187 0.76 CA12 (0.32) PDK1PDK2PDK3PDK4ABCC9
SCHEMBL19862661 0.75 ABCC9 (0.44) PDK1PDK2PDK3PDK4ABCC9
SCHEMBL12965354 0.74 TGM2 (0.43) PDK1PDK2PDK3PDK4ABCC9
SCHEMBL12814077 0.71 CA1 (0.43) PDK1PDK2PDK3PDK4ABCC9
SCHEMBL19862674 0.71 CYP3A4 (0.34) KMT2AMEN1CYP1A2CYP3A4CYP2D6
SCHEMBL19862670 0.69 SMN1; SMN2 (0.41) ABCC9ABCC8KCNJ11KCNJ8KMT2A
SCHEMBL12965599 0.68 PDK1 (0.40) PDK1PDK2PDK3PDK4ABCC9

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-9951164-B2 Non-ionic aryl ketone based polymeric photo-acid generators INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2018-04-24 US disclosed
US-20180044459-A1 NON-IONIC ARYL KETONE BASED POLYMERIC PHOTO-ACID GENERATORS CENTRAL GLASS CO., LTD. (JP) 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-20180044459-A1 NON-IONIC ARYL KETONE BASED POLYMERIC PHOTO-ACID GENERATORS PPARG, PPARA, PPARD PDK1 242/4885PDK2 76/4885PDK3 180/4885

“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.