SCHEMBL13005543

SCHEMBL13005543

CC(C)(C)[Si](C)(C)OCCCc1c[nH]c2ncnc(Cl)c12

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CHEK1 O14757 2/20 0.40
▸ DUT P33316 1/20 0.33
▸ PRKD3 O94806 2/20 0.32
▸ MAP4K4 O95819 2/20 0.32
▸ PAK4 O96013 2/20 0.32
▸ NTRK1 P04629 2/20 0.32
▸ PRKACA P17612 2/20 0.32
▸ CLK2 P49760 2/20 0.32
▸ GSK3A P49840 2/20 0.32
▸ GSK3B P49841 2/20 0.32
▸ CDK5 Q00535 2/20 0.32
▸ MAP4K2 Q12851 2/20 0.32
▸ ROCK1 Q13464 2/20 0.32
▸ DYRK1A Q13627 2/20 0.32
▸ NTRK3 Q16288 2/20 0.32
▸ TAOK1 Q7L7X3 2/20 0.32
▸ CDC7 O00311 1/20 0.32
▸ PLK4 O00444 1/20 0.32
▸ CHUK O15111 1/20 0.32
▸ PDPK1 O15530 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
SCHEMBL31618054 1.00 CHEK1 (0.40) CHEK1DUTPRKD3MAP4K4PAK4
SCHEMBL3285768 0.93 CHEK1 (0.42) CHEK1PRKD3MAP4K4PAK4NTRK1
SCHEMBL3224749 0.85 CHEK1 (0.44) CHEK1PRKD3MAP4K4PAK4NTRK1
SCHEMBL31361298 0.80 SLC6A4 (0.36) DUT
SCHEMBL13060746 0.77 CHEK1 (0.41) CHEK1PRKD3MAP4K4PRKACACLK2
SCHEMBL16765811 0.76 CHEK1 (0.49) CHEK1PRKD3MAP4K4PAK4NTRK1
SCHEMBL3372101 0.76 CHEK1 (0.40) CHEK1AURKAJAK3
SCHEMBL13060461 0.76 CHEK1 (0.40) CHEK1PRKD3MAP4K4PRKACACLK2
SCHEMBL2783376 0.74 CHEK1 (0.53) CHEK1PRKD3MAP4K4PAK4NTRK1
SCHEMBL7249503 0.71 HSP90AB1 (0.32) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100311684-A1 NOVEL TRICYCLIC NUCLEOSIDES OR NUCLEOTIDES AS THERAPEUTIC AGENTS BIOTA SCIENTIFIC MANAGEMENT PTY LTD (AU) 2010-12-09 — — US disclosed
US-7713941-B2 Tricyclic nucleosides or nucleotides as therapeutic agents BIOTA SCIENTIFIC MANAGEMENT PTY LTD (AU) 2010-05-11 — — US disclosed
US-20080200423-A1 Novel Tricyclic Nucleosides or Nucleotides as Therapeutic Agents BIOTA SCIENTIFIC MANAGEMENT PTY LTD (AU) 2008-08-21 — — US disclosed
US-7268119-B2 Tricyclic nucleosides or nucleotides as therapeutic agents BIOTA SCIENTIFIC MANAGEMENT PTY LTD (AU) 2007-09-11 — — US disclosed
US-20070135363-A1 NOVEL TRICYCLIC NUCLEOSIDES OR NUCLEOTIDES AS THERAPEUTIC AGENTS BIOTA, INC. (US) 2007-06-14 — — 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 (3 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-20070135363-A1 NOVEL TRICYCLIC NUCLEOSIDES OR NUCLEOTIDES AS THERAPEUTIC AGENTS NTPCR, NME1, NME2 CHEK1 484/4885DUT 21/4885PRKD3 675/4885
US-20080200423-A1 Novel Tricyclic Nucleosides or Nucleotides as Therapeutic Agents NME1, NME2, NTPCR CHEK1 444/4885DUT 14/4885PRKD3 696/4885
US-20100311684-A1 NOVEL TRICYCLIC NUCLEOSIDES OR NUCLEOTIDES AS THERAPEUTIC AGENTS NTPCR, NME1, NME2 CHEK1 484/4885DUT 21/4885PRKD3 675/4885

“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.

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