SCHEMBL4164022

SCHEMBL4164022

OCc1cc(F)cc2c1sc1c(CO)cc(Cl)cc12

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 1/20 0.31
EPAS1 Q99814 1/20 0.31

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
SCHEMBL4168887 0.83
SCHEMBL4155956 0.79 CYP2A6 (0.31)
SCHEMBL4166529 0.76 CYP1A2 (0.50)
Bromide SCHEMBL4161301 0.75 CYP1A2 (0.49)
SCHEMBL25616004 0.64 CYP4F2 (0.33)
SCHEMBL4019278 0.64 CYP4F2 (0.34) PDK2
SCHEMBL17414233 0.63 PDK2 (0.44) PDK2EPAS1
SCHEMBL11319543 0.63 PDK2 (0.37) PDK2EPAS1
SCHEMBL11319176 0.63 CYP1A2 (0.39) PDK2
SCHEMBL1057960 0.61 KDM4E (0.43)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090069408-A1 TRICYCLIC COMPOUNDS USEFUL IN TREATING IRON DISORDERS XENON PHARMACEUTICALS INC. (CA) 2009-03-12 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-20090069408-A1 TRICYCLIC COMPOUNDS USEFUL IN TREATING IRON DISORDERS TFRC, SLC40A1, FECH PDK2 2112/4885EPAS1 3845/4885

“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.