SCHEMBL5469159

SCHEMBL5469159

Cc1cc2n[nH]c(=O)n2c2ccc(-c3ccc(CN4CCC[C@H]4CO)cc3)cc12

nearest known ligand 0.57

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CHEK1 O14757 12/20 0.57
SPHK1 Q9NYA1 8/20 0.49
SPHK2 Q9NRA0 1/20 0.47

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
SCHEMBL5475790 0.84 SPHK1 (0.47) CHEK1SPHK1SPHK2
SCHEMBL5480684 0.84 CHEK1 (0.66) CHEK1
SCHEMBL5480730 0.80 CHEK1 (0.83) CHEK1
SCHEMBL5470153 0.79 CHEK1 (0.85) CHEK1
SCHEMBL5472874 0.74 CHEK1 (0.63) CHEK1
SCHEMBL5476538 0.74 CHEK1 (0.44) CHEK1SPHK1
SCHEMBL5475730 0.73 CHEK1 (0.44) CHEK1
SCHEMBL5470143 0.72 CHEK1 (1.00) CHEK1
SCHEMBL14492186 0.72 CHEK1 (0.61) CHEK1
SCHEMBL5468809 0.72 CHEK1 (0.59) CHEK1

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-20070149560-A1 Novel fused triazolones and the uses thereof ASTRAZENECA AB (SE) 2007-06-28 US claimed
US-20070149560-A1 Novel fused triazolones and the uses thereof ASTRAZENECA AB (SE) 2007-06-28 US disclosed
EP-1613625-A1 NOVEL FUSED TRIAZOLONES AND THE USES THEREOF AstraZeneca AB (SE) 2006-01-11 EP disclosed
WO-2004081008-A1 NOVEL FUSED TRIAZOLONES AND THE USES THEREOF ASTRAZENECA AB (SE) 2004-09-23 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-20070149560-A1 Novel fused triazolones and the uses thereof TP53, BRCA1, KLK3 CHEK1 13/4885SPHK1 1906/4885SPHK2 1371/4885

“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.