SCHEMBL215726

SCHEMBL215726

CSc1ncc2c(=O)n3c(nc2n1)c1c(OS(=O)(=O)C(F)(F)F)cccc1n3-c1ccccn1

nearest known ligand 0.34

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
DPP4 P27487 1/20 0.30

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
SCHEMBL188969 0.85 MEN1 (0.34) MEN1KMT2ADPP4
SCHEMBL188248 0.85 MEN1 (0.34) MEN1KMT2ADPP4
SCHEMBL8510234 0.84 MEN1 (0.35) MEN1KMT2ADPP4
SCHEMBL8513198 0.83 MEN1 (0.37) MEN1KMT2ADPP4
SCHEMBL2871226 0.82 MEN1 (0.38) MEN1KMT2ADPP4
SCHEMBL188485 0.80 MEN1 (0.40) MEN1KMT2ADPP4
SCHEMBL215643 0.78 TSHR (0.35) MEN1KMT2A
SCHEMBL219010 0.78 MEN1 (0.37) MEN1KMT2ADPP4
SCHEMBL215794 0.76 WEE1 (0.36)
SCHEMBL2875942 0.74 MEN1 (0.37) MEN1KMT2ADPP4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8288396-B2 Pyrimidopyrimidoindazole derivative MSDKK (JP) 2012-10-16 US disclosed
US-20120134955-A1 PYRIMIDOPYRIMIDOINDAZOLE DERIVATIVE MSD K.K. (JP) 2012-05-31 US disclosed
EP-2401281-A1 PYRIMIDOPYRIMIDOINDAZOLE DERIVATIVE MSD K.K. (JP) 2012-01-04 EP disclosed
WO-2010098367-A1 PYRIMIDOPYRIMIDOINDAZOLE DERIVATIVE BANYU PHARMACEUTICAL CO.,LTD. (JP) 2010-09-02 WO 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-20120134955-A1 PYRIMIDOPYRIMIDOINDAZOLE DERIVATIVE WEE1, WEE2, DCK MEN1 3601/4885KMT2A 3701/4885DPP4 4375/4885

“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.