SCHEMBL12499205

SCHEMBL12499205

COc1cc(Br)ccc1Nc1ncc2c(n1)-c1noc(C(=O)O)c1CCC2

nearest known ligand 0.65

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TTK P33981 14/20 0.65
PIM1 P11309 1/20 0.49
PIM2 Q9P1W9 1/20 0.49
IGF1R P08069 5/20 0.46
EIF2AK3 Q9NZJ5 1/20 0.44
CCNA2 P20248 2/20 0.43
CDK2 P24941 2/20 0.43
PLK1 P53350 2/20 0.43
CCNA1 P78396 2/20 0.43
PLK3 Q9H4B4 2/20 0.43
PLK2 Q9NYY3 2/20 0.43
AURKA O14965 1/20 0.42

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
SCHEMBL525856 0.95 TTK (0.57) TTKPIM1PIM2IGF1REIF2AK3
SCHEMBL15377850 0.89 TTK (0.60) TTKPIM1PIM2IGF1REIF2AK3
SCHEMBL12499646 0.88 TTK (0.63) TTKPIM1PIM2IGF1REIF2AK3
SCHEMBL526272 0.88 TTK (0.57) TTKPIM1PIM2IGF1REIF2AK3
SCHEMBL525576 0.85 TTK (0.55) TTKPIM1PIM2IGF1REIF2AK3
SCHEMBL12698170 0.85 TTK (0.78) TTKCCNA2CDK2PLK1CCNA1
SCHEMBL525752 0.84 TTK (0.54) TTKPIM1IGF1REIF2AK3CCNA2
SCHEMBL12698407 0.83 TTK (0.70) TTKPIM1PIM2IGF1RCCNA2
SCHEMBL15378149 0.82 TTK (0.69) TTKPIM1PIM2IGF1RCCNA2
Potassium SCHEMBL15378152 0.82 TTK (0.69) TTKPIM1PIM2IGF1RCCNA2

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
EP-2668188-B1 TRICYCLIC DERIVATIVES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS KINASE INHIBITORS NERVIANO MEDICAL SCIENCES SRL (IT) 2016-05-18 EP disclosed
US-8916577-B2 Tricyclic derivatives, process for their preparation and their use as kinase inhibitors NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2014-12-23 US disclosed
EP-2668188-A1 TRICYCLIC DERIVATIVES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS KINASE INHIBITORS Nerviano Medical Sciences S.r.l. (IT) 2013-12-04 EP disclosed
US-20130302416-A1 TRICYCLIC DERIVATIVES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS KINASE INHIBITORS NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2013-11-14 US disclosed
WO-2012101029-A1 TRICYCLIC DERIVATIVES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS KINASE INHIBITORS NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2012-08-02 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-20130302416-A1 TRICYCLIC DERIVATIVES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS KINASE INHIBITORS CDK1, MAP3K1, MAP3K20 TTK 223/4885PIM1 715/4885PIM2 726/4885

“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.