SCHEMBL311022

SCHEMBL311022

C[Si](C)(C)C#Cc1n[nH]c2ncnc(Cl)c12

nearest known ligand 0.36

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CHEK1 O14757 1/20 0.36
AURKA O14965 1/20 0.33

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
SCHEMBL4725800 0.77 CHEK1 (0.40) CHEK1AURKA
SCHEMBL1735020 0.72 CHEK1 (0.50) CHEK1AURKA
SCHEMBL1128452 0.72 CHEK1 (0.47) CHEK1AURKA
SCHEMBL1128551 0.71 CHEK1 (0.43) CHEK1AURKA
SCHEMBL1128852 0.70 CHEK1 (0.40) CHEK1AURKA
Methane SCHEMBL10423240 0.70 CHEK1 (0.46) CHEK1AURKA
SCHEMBL1129156 0.68 AURKA (0.38) CHEK1AURKA
SCHEMBL9918632 0.68 CCR4 (0.50) CHEK1AURKA
SCHEMBL473315 0.67 CHEK1 (0.43) CHEK1AURKA
SCHEMBL311873 0.67 CHEK1 (0.52) CHEK1AURKA

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
EP-2148880-B1 P70 S6 KINASE INHIBITORS LILLY CO ELI (US) 2014-05-28 EP disclosed
US-20120071490-A1 P70 S6 KINASE INHIBITORS ELI LILLY AND COMPANY (US) 2012-03-22 US disclosed
US-8093383-B2 P70 S6 kinase inhibitors ELI LILLY AND COMPANY (US) 2012-01-10 US disclosed
US-20090163714-A1 P70 S6 KINASE INHIBITORS ELI LILLY AND COMPANY 2009-06-25 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 (2 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-20090163714-A1 P70 S6 KINASE INHIBITORS RPS6KA6, RPS6KA1, RPS6KA2 CHEK1 521/4885AURKA 906/4885
US-20120071490-A1 P70 S6 KINASE INHIBITORS RPS6KA6, RPS6KA1, RPS6KA2 CHEK1 521/4885AURKA 906/4885

“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.