SCHEMBL13530482

SCHEMBL13530482

CCOP(=O)(Nc1nc(OCc2ccc(OC)c(F)c2)ncc1F)OCC

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HTT P42858 3/20 0.41
ALDH1A1 P00352 3/20 0.41
LMNA P02545 2/20 0.41
HPGD P15428 1/20 0.41
MAPK1 P28482 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
ALKBH1 Q13686 1/20 0.39
MAOB P27338 1/20 0.37
CSF1R P07333 1/20 0.37
KDM4E B2RXH2 1/20 0.36
MITF O75030 1/20 0.36
PDE5A O76074 1/20 0.35
BCL6 P41182 1/20 0.35

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
SCHEMBL3189376 0.85 ALDH1A1 (0.39) ALDH1A1LMNAHPGDMAPK1MAOB
SCHEMBL13530438 0.84 KDM4E (0.46) ALDH1A1LMNAHPGDMAPK1MAOB
SCHEMBL13530322 0.83 MAOB (0.40) ALDH1A1MAOB
SCHEMBL13529480 0.82 NPSR1 (0.43) ALDH1A1LMNAHPGDMAPK1KDM4E
SCHEMBL13530097 0.82 PARP14 (0.38) ALDH1A1LMNAHPGDKDM4E
SCHEMBL13530077 0.81 ALDH1A1 (0.40) HTTALDH1A1LMNAHPGDMAPK1
SCHEMBL13530405 0.81 LMNA (0.43) HTTALDH1A1LMNAHPGDMAPK1
SCHEMBL17011537 0.80 CSF1R (0.40) HTTALDH1A1LMNAHPGDMAPK1
SCHEMBL13529696 0.79 LMNA (0.44) HTTALDH1A1LMNAHPGDMAPK1
SCHEMBL13530349 0.79 FFAR1 (0.41) ALDH1A1MAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9204653-B2 5-fluoro pyrimidine derivatives DOW AGROSCIENCES LLC (US) 2015-12-08 US disclosed
US-9204653-B2 5-fluoro pyrimidine derivatives DOW AGROSCIENCES LLC (US) 2015-12-08 US disclosed
US-9174970-B2 5-fluoro pyrimidine derivatives DOW AGROSCIENCES LLC (US) 2015-11-03 US disclosed
US-9174970-B2 5-fluoro pyrimidine derivatives DOW AGROSCIENCES LLC (US) 2015-11-03 US disclosed
EP-2252594-B1 4-AMINO-5-FLUORO-PYRIMIDINE DERIVATIVES AS FUNGICIDES DOW AGROSCIENCES LLC (US) 2015-08-19 EP disclosed
US-20140024616-A1 5-FLUORO PYRIMIDINE DERIVATIVES DOW AGROSCIENCES LLC (US) 2014-01-23 US disclosed
US-20140024616-A1 5-FLUORO PYRIMIDINE DERIVATIVES DOW AGROSCIENCES LLC (US) 2014-01-23 US disclosed
US-20100022538-A1 5-FLUORO PYRIMIDINE DERIVATIVES DOW AGROSCIENCES LLC (US) 2010-01-28 US disclosed
US-20090203647-A1 5-FLUORO PYRIMIDINE DERIVATIVES DOW AGROSCIENCES LLC (US) 2009-08-13 US disclosed
US-20090203647-A1 5-FLUORO PYRIMIDINE DERIVATIVES DOW AGROSCIENCES LLC (US) 2009-08-13 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 (3 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-20100022538-A1 5-FLUORO PYRIMIDINE DERIVATIVES DPYD, DPM1, DDX5 HTT 4162/4885ALDH1A1 1302/4885LMNA 4636/4885
US-20140024616-A1 5-FLUORO PYRIMIDINE DERIVATIVES DPYD, DPM1, DDX5 HTT 4162/4885ALDH1A1 1302/4885LMNA 4636/4885
US-20090203647-A1 5-FLUORO PYRIMIDINE DERIVATIVES DPYD, DPM1, DDX5 HTT 4162/4885ALDH1A1 1302/4885LMNA 4636/4885

“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.