SCHEMBL14965449

SCHEMBL14965449

COc1cc(CCN(CC2CCN(C(=O)OC(C)(C)C)CC2)C(=O)OC(C)(C)C)c(Cl)cc1NC(=O)Nc1cnc(C#N)cn1

nearest known ligand 0.57

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CHEK1 O14757 20/20 0.57
RPS6KB1 P23443 1/20 0.56
FLT4 P35916 1/20 0.56
FLT3 P36888 1/20 0.56
RPS6KA3 P51812 1/20 0.56
PRKAA1 Q13131 1/20 0.56
PRKD2 Q9BZL6 1/20 0.56

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
SCHEMBL14968860 0.95 CHEK1 (0.57) CHEK1RPS6KB1FLT4FLT3RPS6KA3
SCHEMBL2589950 0.86 CHEK1 (0.63) CHEK1RPS6KB1FLT4FLT3RPS6KA3
SCHEMBL14965448 0.85 CHEK1 (0.53) CHEK1RPS6KB1FLT4FLT3RPS6KA3
SCHEMBL2596018 0.81 CHEK1 (0.61) CHEK1RPS6KB1FLT4FLT3RPS6KA3
SCHEMBL14965103 0.81 CHEK1 (0.71) CHEK1RPS6KB1FLT4FLT3RPS6KA3
SCHEMBL19282120 0.81 CHEK1 (0.71) CHEK1RPS6KB1FLT4FLT3RPS6KA3
SCHEMBL2595563 0.81 CHEK1 (0.69) CHEK1
SCHEMBL14774902 0.81 CHEK1 (0.63) CHEK1RPS6KB1FLT4FLT3RPS6KA3
SCHEMBL14761985 0.80 CHEK1 (0.70) CHEK1RPS6KB1FLT4FLT3RPS6KA3
SCHEMBL14969460 0.79 CHEK1 (0.55) 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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170247341-A1 PHARMACEUTICALLY ACTIVE PYRAZINE DERIVATIVES SENTINEL ONCOLOGY LIMITED (GB) 2017-08-31 US disclosed
US-20170247341-A1 PHARMACEUTICALLY ACTIVE PYRAZINE DERIVATIVES SENTINEL ONCOLOGY LIMITED (GB) 2017-08-31 US disclosed
US-9630931-B2 Pharmaceutically active pyrazine derivatives SENTINEL ONCOLOGY LIMITED (GB) 2017-04-25 US disclosed
US-9630931-B2 Pharmaceutically active pyrazine derivatives SENTINEL ONCOLOGY LIMITED (GB) 2017-04-25 US disclosed
EP-2780331-B1 PHARMACEUTICALLY ACTIVE PYRAZINE DERIVATIVES SENTINEL ONCOLOGY LTD (GB) 2016-04-20 EP disclosed
US-20140323484-A1 Pharmaceutically Active Pyrazine Derivatives SENTINEL ONCOLOGY LIMITED (GB) 2014-10-30 US disclosed
US-20140323484-A1 Pharmaceutically Active Pyrazine Derivatives SENTINEL ONCOLOGY LIMITED (GB) 2014-10-30 US disclosed
EP-2780331-A1 PHARMACEUTICALLY ACTIVE PYRAZINE DERIVATIVES Sentinel Oncology Limited (GB) 2014-09-24 EP disclosed
WO-2013072502-A1 PHARMACEUTICALLY ACTIVE PYRAZINE DERIVATIVES SENTINEL ONCOLOGY LIMITED (GB) 2013-05-23 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 (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-20140323484-A1 Pharmaceutically Active Pyrazine Derivatives PHKG1, PHKG2, PLK2 CHEK1 36/4885RPS6KB1 269/4885FLT4 1232/4885
US-20170247341-A1 PHARMACEUTICALLY ACTIVE PYRAZINE DERIVATIVES PHKG1, PHKG2, PEAK1 CHEK1 29/4885RPS6KB1 277/4885FLT4 1127/4885

“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.