SCHEMBL19863243

SCHEMBL19863243

CC(C(=O)c1cccc(-c2ccccc2)c1)C(F)(F)F

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMO O15229 1/20 0.51
HDAC8 Q9BY41 1/20 0.47
ERCC5 P28715 1/20 0.44
FEN1 P39748 1/20 0.44
RXRA P19793 3/20 0.43
RXRB P28702 3/20 0.43
RXRG P48443 1/20 0.43
PRSS1 P07477 1/20 0.42
PRSS2 P07478 1/20 0.42
PRSS3 P35030 1/20 0.42
AKR1C3 P42330 2/20 0.42
AKR1C2 P52895 2/20 0.42
PTPN5 P54829 3/20 0.41
PTPN1 P18031 1/20 0.41
MAPT P10636 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
LMNA P02545 1/20 0.41
GAA P10253 1/20 0.41
PDK2 Q15119 1/20 0.41
DHODH Q02127 1/20 0.41

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
SCHEMBL19863252 0.85 SMN1; SMN2 (0.53) MAPTLMNA
SCHEMBL2201172 0.84 CES1 (0.48) PTPN1MAPTTDP1LMNA
Hydrochloric Acid SCHEMBL5819903 0.83 CES1 (0.47) PTPN1MAPTTDP1LMNA
SCHEMBL10276830 0.81 KMO (0.60) KMOHDAC8ERCC5FEN1RXRA
SCHEMBL19863240 0.80 SLC6A2 (0.51) HDAC8TDP1ACHE
SCHEMBL19865862 0.79 CES2 (0.61) LMNAGAAACHE
SCHEMBL9039300 0.78 KMO (0.56) KMOHDAC8ERCC5FEN1RXRA
SCHEMBL19866847 0.76 CES2 (0.57) PRSS1PRSS2PRSS3
SCHEMBL14564385 0.75 KMO (0.62) KMOHDAC8ERCC5FEN1RXRA
SCHEMBL4560389 0.75 KMO (0.53) KMOHDAC8ERCC5FEN1RXRA

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 KMO 397/4885HDAC8 2277/4885ERCC5 1128/4885

“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.