SCHEMBL13853252

SCHEMBL13853252

FC(F)(F)c1ccc2c(Cl)ncnc2n1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 2/20 0.36
PDE4B Q07343 2/20 0.36
PDE4C Q08493 2/20 0.36
PDE4D Q08499 2/20 0.36
ALDH1A1 P00352 2/20 0.36
KDM4E B2RXH2 2/20 0.36
KMT2A Q03164 1/20 0.36
MAPT P10636 3/20 0.33
GAA P10253 2/20 0.33
RAB9A P51151 2/20 0.33
TRPV4 Q9HBA0 1/20 0.33
MAT2A P31153 3/20 0.33
NT5E P21589 1/20 0.33
CA2 P00918 1/20 0.32
CHKA P35790 1/20 0.32
LMNA P02545 2/20 0.32
NPC1 O15118 1/20 0.32
HTT P42858 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32

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
SCHEMBL5264672 0.79 ALDH1A1 (0.36) ALDH1A1KDM4EKMT2AMAPTGAA
SCHEMBL4195175 0.79 ALDH1A1 (0.36) PDE4BALDH1A1KDM4EKMT2AMAPT
SCHEMBL13853257 0.79 ADK (0.44) ALDH1A1KDM4EKMT2AMAPTGAA
SCHEMBL13853282 0.79 ALDH1A1 (0.39) PDE4BALDH1A1KDM4EKMT2AMAPT
SCHEMBL2173613 0.76 ALDH1A1 (0.40) ALDH1A1KDM4EKMT2AMAPTGAA
SCHEMBL6836394 0.76 EGFR (0.43) PDE4APDE4BPDE4CPDE4DALDH1A1
SCHEMBL23066113 0.75 ALDH1A1 (0.39) ALDH1A1KDM4EKMT2AMAPTGAA
SCHEMBL2648851 0.75 RPS6KB1 (0.36) ALDH1A1KDM4EKMT2AMAPTGAA
SCHEMBL6833680 0.75 PDE4A (0.42) PDE4APDE4BPDE4CPDE4DALDH1A1
SCHEMBL13853262 0.75 MAT2A (0.35) ALDH1A1KDM4EKMT2AMAPTGAA

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-20090137558-A1 Pyridine based compounds useful as intermediates for pharmaceutical or agricultural end-products PEAKDALE MOLECULAR LIMITED (GB) 2009-05-28 US disclosed
US-20090137558-A1 Pyridine based compounds useful as intermediates for pharmaceutical or agricultural end-products PEAKDALE MOLECULAR LIMITED (GB) 2009-05-28 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-20090137558-A1 Pyridine based compounds useful as intermediates for pharmaceutical or agricultural end-products PNPO, CYP4B1, PDXK PDE4A 517/4885PDE4B 378/4885PDE4C 571/4885

“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.