SCHEMBL710463

SCHEMBL710463

FC(F)(F)c1cnc(-c2ccnc3ncnn23)c(Br)c1

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.43
EGLN2 Q96KS0 8/20 0.43
ALDH1A1 P00352 8/20 0.42
KDM4E B2RXH2 6/20 0.41
RCE1 Q9Y256 1/20 0.41
GAA P10253 3/20 0.40
GLA P06280 2/20 0.40
HPGD P15428 2/20 0.40
MBOAT4 Q96T53 1/20 0.39
RXFP1 Q9HBX9 1/20 0.36
MAPT P10636 1/20 0.36
KMT2A Q03164 1/20 0.36
NPSR1 Q6W5P4 1/20 0.35
L3MBTL1 Q9Y468 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
SCHEMBL708758 0.85 EGLN2 (0.45) SMN1; SMN2EGLN2ALDH1A1KDM4ERCE1
SCHEMBL710043 0.77 MBOAT4 (0.41) SMN1; SMN2ALDH1A1KDM4EGAAHPGD
SCHEMBL11468935 0.72 KDM4E (0.56) SMN1; SMN2EGLN2ALDH1A1KDM4ERCE1
SCHEMBL11484815 0.66 ALDH1A1 (0.54) SMN1; SMN2EGLN2ALDH1A1KDM4ERCE1
SCHEMBL710035 0.66 ALDH1A1 (0.43) SMN1; SMN2ALDH1A1KDM4EGAAHPGD
SCHEMBL710462 0.65 ALDH1A1 (0.40) SMN1; SMN2ALDH1A1KDM4EGAAHPGD
SCHEMBL709421 0.65 KDM4E (0.51) SMN1; SMN2ALDH1A1KDM4EGAAHPGD
SCHEMBL710046 0.64 PDE2A (0.39) SMN1; SMN2ALDH1A1KDM4EGAAHPGD
SCHEMBL710042 0.63 PDE2A (0.42) SMN1; SMN2ALDH1A1KDM4EGAAHPGD
SCHEMBL3378140 0.62 MBOAT4 (0.43) SMN1; SMN2ALDH1A1KDM4EGLAHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2118113-B1 PYRIDYL-TRIAZOLOPYRIMIDINE DERIVATIVE OR ITS SALT, PESTICIDE CONTAINING IT AND ITS PRODUCTION PROCESS ISHIHARA SANGYO KAISHA (JP) 2013-01-30 EP disclosed
US-8124760-B2 Pyridyl-triazolopyrimidine derivative or its salt, pesticide containing it and its production process ISHIHARA SANGYO KAISHA, LTD. (JP) 2012-02-28 US disclosed
US-20100087452-A1 PYRIDYL-TRIAZOLOPYRIMIDINE DERIVATIVE OR ITS SALT, PESTICIDE CONTAINING IT AND ITS PRODUCTION PROCESS ISHIHARA SANGYO KAISHA, LTD (JP) 2010-04-08 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-20100087452-A1 PYRIDYL-TRIAZOLOPYRIMIDINE DERIVATIVE OR ITS SALT, PESTICIDE CONTAINING IT AND ITS PRODUCTION PROCESS SCN5A, CHRNA5, NR5A2 SMN1; SMN2 3356/4885EGLN2 4182/4885ALDH1A1 1866/4885

“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.