SCHEMBL13530586

SCHEMBL13530586

Oc1ccc(COc2ncc(F)c(NCc3ccccc3F)n2)cc1O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.44
MAOB P27338 8/20 0.41
EGFR P00533 1/20 0.39
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
MAPT P10636 2/20 0.37
PKM P14618 2/20 0.37
VNN1 O95497 1/20 0.37
ALDH1A1 P00352 1/20 0.37
ESR1 P03372 1/20 0.37
TP53 P04637 1/20 0.37
GAA P10253 1/20 0.37
THRB P10828 1/20 0.37
ALOX12 P18054 1/20 0.37
BLM P54132 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
ESR2 Q92731 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.36
HRAS P01112 1/20 0.36

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
SCHEMBL13530527 0.88 MAOB (0.46) KDM4EMAOBEGFRMEN1KMT2A
SCHEMBL3185270 0.85 MAOB (0.45) KDM4EMAOBMEN1KMT2APKM
SCHEMBL13530454 0.85 ALDH1A1 (0.46) KDM4EMEN1KMT2AMAPTVNN1
SCHEMBL13732587 0.85 MEN1 (0.49) KDM4EMAOBMEN1KMT2AMAPT
SCHEMBL13530532 0.84 LMNA (0.50) KDM4EMAOBMEN1KMT2AMAPT
SCHEMBL13530512 0.84 MAPT (0.45) KDM4EMAOBMEN1KMT2AMAPT
SCHEMBL1448423 0.83 LMNA (0.46) KDM4EMAOBMEN1KMT2AMAPT
SCHEMBL13530631 0.83 MEN1 (0.49) KDM4EMAOBMEN1KMT2AMAPT
SCHEMBL13530640 0.83 MAOB (0.45) KDM4EMAOBMEN1KMT2AMAPT
SCHEMBL13530611 0.82 L3MBTL1 (0.53) KDM4EMAOBEGFRMEN1KMT2A

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-20100022538-A1 5-FLUORO PYRIMIDINE DERIVATIVES DOW AGROSCIENCES LLC (US) 2010-01-28 US disclosed
US-20100022538-A1 5-FLUORO PYRIMIDINE DERIVATIVES DOW AGROSCIENCES LLC (US) 2010-01-28 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-20100022538-A1 5-FLUORO PYRIMIDINE DERIVATIVES DPYD, DPM1, DDX5 KDM4E 1768/4885MAOB 1396/4885EGFR 4225/4885

“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.