SCHEMBL13530659

SCHEMBL13530659

Fc1ccccc1CNc1nc(OCc2c(Cl)cccc2Cl)ncc1F

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.40
KMT2A Q03164 4/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
CYP1A2 P05177 2/20 0.40
CYP2C9 P11712 2/20 0.40
CYP2C19 P33261 2/20 0.40
ATM Q13315 2/20 0.40
HTT P42858 2/20 0.40
MAPT P10636 1/20 0.40
PLA2G1B P04054 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2D6 P10635 1/20 0.40
ATG4B Q9Y4P1 1/20 0.40
PKM P14618 1/20 0.40
P2RX7 Q99572 1/20 0.39
ALDH1A1 P00352 1/20 0.39
HPGD P15428 1/20 0.39
KDM4E B2RXH2 1/20 0.39
ABL1 P00519 2/20 0.37
SRC P12931 1/20 0.37

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
SCHEMBL13530602 0.91 MEN1 (0.42) MEN1KMT2AL3MBTL1CYP1A2CYP2C9
SCHEMBL13530512 0.86 MAPT (0.45) MEN1KMT2AL3MBTL1CYP1A2CYP2C9
SCHEMBL13530631 0.84 MEN1 (0.49) MEN1KMT2AL3MBTL1CYP1A2CYP2C9
SCHEMBL13530640 0.83 MAOB (0.45) MEN1KMT2AL3MBTL1CYP1A2CYP2C9
SCHEMBL13732587 0.83 MEN1 (0.49) MEN1KMT2AL3MBTL1CYP1A2CYP2C9
SCHEMBL13530565 0.83 FNTA (0.44) MEN1KMT2AL3MBTL1CYP1A2CYP2C9
SCHEMBL13530454 0.83 ALDH1A1 (0.46) MEN1KMT2AL3MBTL1CYP1A2CYP2C19
SCHEMBL13530611 0.83 L3MBTL1 (0.53) MEN1KMT2AL3MBTL1CYP1A2CYP2C9
SCHEMBL13530536 0.82 TSHR (0.47) MEN1KMT2ACYP1A2CYP2C9CYP2C19
SCHEMBL13530636 0.81 MAOB (0.43) MEN1KMT2AL3MBTL1CYP1A2CYP2C9

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
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-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 MEN1 3460/4885KMT2A 3037/4885L3MBTL1 896/4885
US-20140024616-A1 5-FLUORO PYRIMIDINE DERIVATIVES DPYD, DPM1, DDX5 MEN1 3460/4885KMT2A 3037/4885L3MBTL1 896/4885
US-20090203647-A1 5-FLUORO PYRIMIDINE DERIVATIVES DPYD, DPM1, DDX5 MEN1 3460/4885KMT2A 3037/4885L3MBTL1 896/4885

“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.