SCHEMBL4568243

SCHEMBL4568243

O=C(Nc1cc(Cl)c(F)cc1I)C(F)(F)F

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.41
LMNA P02545 1/20 0.41
KMT2A Q03164 1/20 0.41
PDK1 Q15118 8/20 0.36
PDK2 Q15119 8/20 0.36
PDK3 Q15120 8/20 0.36
PDK4 Q16654 8/20 0.36
TRPV1 Q8NER1 1/20 0.36
PTPN5 P54829 1/20 0.35
CA1 P00915 2/20 0.35
CA2 P00918 2/20 0.35
L3MBTL1 Q9Y468 1/20 0.34
SLC2A1 P11166 1/20 0.34
HTT P42858 1/20 0.34

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
SCHEMBL31312693 0.86 PTPN5 (0.39) MEN1LMNAKMT2APDK1PDK2
SCHEMBL24687401 0.85 MEN1 (0.40) MEN1LMNAKMT2APDK1PDK2
SCHEMBL16050285 0.83 MEN1 (0.40) MEN1LMNAKMT2APDK1PDK2
SCHEMBL23174526 0.81 LMNA (0.43) MEN1LMNAKMT2APDK1PDK2
SCHEMBL16122523 0.79 PDK1 (0.40) MEN1LMNAKMT2APDK1PDK2
SCHEMBL16050349 0.79 MEN1 (0.40) MEN1LMNAKMT2APDK1PDK2
SCHEMBL3932786 0.77 HPGD (0.41) MEN1LMNAKMT2AHTT
SCHEMBL31515136 0.76 PDK1 (0.40) MEN1LMNAKMT2APDK1PDK2
SCHEMBL4568029 0.75 PDK1 (0.50) MEN1LMNAKMT2APDK1PDK2
SCHEMBL1197587 0.75 PDK1 (0.50) MEN1LMNAKMT2APDK1PDK2

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-2474530-B1 INDOLE DERIVATIVE AND PHARMACOLOGICALLY ACCEPTABLE SALT THEREOF KISSEI PHARMACEUTICAL (JP) 2014-09-03 EP disclosed
US-20120122931-A1 INDOLE DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF KISSEI PHARMACEUTICAL CO., LTD. (JP) 2012-05-17 US disclosed
US-20120122931-A1 INDOLE DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF KISSEI PHARMACEUTICAL CO., LTD. (JP) 2012-05-17 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-20120122931-A1 INDOLE DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF PTGER1, CYSLTR1, LTB4R MEN1 2993/4885LMNA 4472/4885KMT2A 2056/4885

“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.