SCHEMBL1907333

SCHEMBL1907333

CC(CO)Nc1nc2oc(-c3ccc(C4(N)CCC4)cc3)c(-c3ccccc3)c2c(=O)n1C

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
AURKA O14965 1/20 0.46
AKT1 P31749 17/20 0.39
AKT2 P31751 9/20 0.37
EGFR P00533 2/20 0.37
JAK2 O60674 1/20 0.37
LCK P06239 1/20 0.37
SRC P12931 1/20 0.37
KDR P35968 1/20 0.37
ZAP70 P43403 1/20 0.37
JAK3 P52333 1/20 0.37
TNK2 Q07912 1/20 0.37

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
SCHEMBL1907331 1.00 AURKA (0.46) AURKAAKT1AKT2EGFRJAK2
SCHEMBL1901319 0.88 AURKA (0.44) AURKAEGFRJAK2LCKSRC
SCHEMBL1902277 0.87 AURKA (0.46) AURKAAKT1AKT2
SCHEMBL1901287 0.87 AURKA (0.46) AURKAAKT1AKT2
SCHEMBL1901289 0.87 AURKA (0.46) AURKAAKT1AKT2
SCHEMBL1901112 0.86 CHEK1 (0.43) AURKAAKT1AKT2
SCHEMBL1905142 0.86 AKT1 (0.41) AKT1AKT2
Hydrochloric Acid SCHEMBL14119158 0.86 CHEK1 (0.42) AURKAAKT1AKT2
SCHEMBL1904665 0.85 AKT1 (0.40) AKT1AKT2
Hydrochloric Acid SCHEMBL1901271 0.85 AKT1 (0.41) AKT1AKT2

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-20120309739-A1 AKT / PKB INHIBITORS ALMAC DISCOVERY LIMITED (GB) 2012-12-06 US claimed
US-20120309739-A1 AKT / PKB INHIBITORS ALMAC DISCOVERY LIMITED (GB) 2012-12-06 US disclosed
EP-2496566-A1 AKT / PKB INHIBITORS Almac Discovery Limited (GB) 2012-09-12 EP disclosed
WO-2011055115-A1 AKT / PKB INHIBITORS ALMAC DISCOVERY LIMITED (GB) 2011-05-12 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-20120309739-A1 AKT / PKB INHIBITORS AKT1, AKT2, AKT3 AURKA 527/4885AKT1 1/4885AKT2 2/4885

“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.