SCHEMBL988041

SCHEMBL988041

O=C(O)c1cc(=O)c(OCc2ccccc2)cn1CC(F)(F)F

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MRGPRX4 Q96LA9 2/20 0.42
RXRA P19793 3/20 0.41
RXRB P28702 3/20 0.41
RXRG P48443 3/20 0.41
PTGER1 P34995 2/20 0.41
SRD5A2 P31213 2/20 0.41
SRD5A1 P18405 1/20 0.41
FOLH1 Q04609 1/20 0.40
MAPK14 Q16539 1/20 0.39
NOTUM Q6P988 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39

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
SCHEMBL10670296 0.85 MAPK14 (0.49) PTGER1SRD5A2SRD5A1FOLH1MAPK14
SCHEMBL12949558 0.83 MRGPRX4 (0.41) MRGPRX4PTGER1SRD5A2SRD5A1FOLH1
SCHEMBL12949645 0.82 MAPK14 (0.43) PTGER1MAPK14MEN1KMT2A
SCHEMBL29067974 0.81 SRD5A2 (0.47) MRGPRX4PTGER1SRD5A2SRD5A1FOLH1
SCHEMBL9662923 0.80 SRD5A2 (0.47) MRGPRX4PTGER1SRD5A2SRD5A1FOLH1
SCHEMBL13555543 0.79 MAPK14 (0.38) MRGPRX4MAPK14
SCHEMBL2115801 0.78 SRD5A2 (0.51) MRGPRX4RXRARXRBRXRGPTGER1
SCHEMBL14124908 0.77 FOLH1 (0.46) RXRARXRBRXRGPTGER1SRD5A2
SCHEMBL10668010 0.76 MAPK14 (0.48) PTGER1MAPK14NOTUMMEN1KMT2A
SCHEMBL12949898 0.73 MAPK14 (0.41) RXRARXRBRXRGMAPK14MEN1

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 23 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9938240-B2 Fluorinated derivatives of 3-hydroxypyridin-4-ones APOTEX INC. (CA) 2018-04-10 US disclosed
US-9938240-B2 Fluorinated derivatives of 3-hydroxypyridin-4-ones APOTEX INC. (CA) 2018-04-10 US disclosed
US-20170247329-A1 \"Fluorinated Derivatives of 3-Hydroxypyridin-4-Ones\ APOTEX TECHNOLOGIES INC. (CA) 2017-08-31 US disclosed
US-20170247329-A1 \"Fluorinated Derivatives of 3-Hydroxypyridin-4-Ones\ APOTEX TECHNOLOGIES INC. (CA) 2017-08-31 US disclosed
US-20170088518-A1 Fluorinated Derivatives of 3-Hydroxypyridin-4-Ones THE BANK OF NOVA SCOTIA (CA) 2017-03-30 US disclosed
US-20170088518-A1 Fluorinated Derivatives of 3-Hydroxypyridin-4-Ones THE BANK OF NOVA SCOTIA (CA) 2017-03-30 US disclosed
US-9550733-B2 Fluorinated derivatives of 3-hydroxypyridin-4-ones APOTEX TECHNOLOGIES INC. (CA) 2017-01-24 US disclosed
US-9550733-B2 Fluorinated derivatives of 3-hydroxypyridin-4-ones APOTEX TECHNOLOGIES INC. (CA) 2017-01-24 US disclosed
US-20160083346-A1 Fluorinated Derivatives of 3-Hydroxypyridin-4-Ones APOTEX TECHNOLOGIES INC. (CA) 2016-03-24 US disclosed
US-20160083346-A1 Fluorinated Derivatives of 3-Hydroxypyridin-4-Ones APOTEX TECHNOLOGIES INC. (CA) 2016-03-24 US disclosed
US-20150274665-A1 FLUORINATED DERIVATIVES OF 3-HYDROXYPYRIDIN-4-ONES FLORIDA TURBINE TECHNOLOGIES, INC. 2015-10-01 US disclosed
US-9073865-B2 Fluorinated derivates of 3-hydroxypyridin-4-ones APOTEX TECHNOLOGIES INC. (CA) 2015-07-07 US disclosed
US-9073865-B2 Fluorinated derivates of 3-hydroxypyridin-4-ones APOTEX TECHNOLOGIES INC. (CA) 2015-07-07 US disclosed
EP-2448922-B1 FLUORINATED DERIVATIVES OF 3-HYDROXYPYRIDIN-4-ONES APOTEX TECHNOLOGIES INC (CA) 2014-08-20 EP disclosed
EP-2448922-B1 FLUORINATED DERIVATIVES OF 3-HYDROXYPYRIDIN-4-ONES APOTEX TECHNOLOGIES INC (CA) 2014-08-20 EP disclosed
US-20120270882-A1 FLUORINATED DERIVATES OF 3-HYDROXYPYRIDIN-4-ONES APOTEX TECHNOLOGIES INC. (CA) 2012-10-25 US disclosed
US-20120270882-A1 FLUORINATED DERIVATES OF 3-HYDROXYPYRIDIN-4-ONES APOTEX TECHNOLOGIES INC. (CA) 2012-10-25 US disclosed
EP-2448922-A1 FLUORINATED DERIVATIVES OF 3-HYDROXYPYRIDIN-4-ONES Apotex Technologies Inc. (CA) 2012-05-09 EP disclosed
WO-2011000104-A1 FLUORINATED DERIVATIVES OF 3-HYDROXYPYRIDIN-4-ONES APOTEX TECHNOLOGIES INC. (CA) 2011-01-06 WO disclosed
WO-2011000104-A1 FLUORINATED DERIVATIVES OF 3-HYDROXYPYRIDIN-4-ONES APOTEX TECHNOLOGIES INC. (CA) 2011-01-06 WO 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 (5 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-20160083346-A1 Fluorinated Derivatives of 3-Hydroxypyridin-4-Ones FH, FECH, FPGS MRGPRX4 3471/4885RXRA 2502/4885RXRB 2703/4885
US-20120270882-A1 FLUORINATED DERIVATES OF 3-HYDROXYPYRIDIN-4-ONES FH, FECH, FTH1 MRGPRX4 2638/4885RXRA 3344/4885RXRB 3568/4885
US-20170088518-A1 Fluorinated Derivatives of 3-Hydroxypyridin-4-Ones FH, FECH, FPGS MRGPRX4 3409/4885RXRA 2605/4885RXRB 2788/4885
US-20170247329-A1 \"Fluorinated Derivatives of 3-Hydroxypyridin-4-Ones\ FH, FECH, FPGS MRGPRX4 3747/4885RXRA 2935/4885RXRB 3108/4885
US-20150274665-A1 FLUORINATED DERIVATIVES OF 3-HYDROXYPYRIDIN-4-ONES FH, FECH, TFRC MRGPRX4 2287/4885RXRA 3108/4885RXRB 3373/4885

“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.