SCHEMBL292362

SCHEMBL292362

CC(C)(CN(C(=O)CBr)c1cc(F)ccc1Cl)NC(=O)OC(C)(C)C

nearest known ligand 0.38

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
AKT1 P31749 2/20 0.38
AAK1 Q2M2I8 9/20 0.35
CDK9 P50750 1/20 0.33
KCNQ4 P56696 3/20 0.32
KCNQ5 Q9NR82 3/20 0.32
ANO1 Q5XXA6 1/20 0.32
KDM4D Q6B0I6 1/20 0.32
EPAS1 Q99814 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
SCHEMBL291652 0.88 AKT1 (0.39) AKT1AAK1KCNQ4KCNQ5
SCHEMBL291831 0.84 AKT1 (0.46) AKT1AAK1
SCHEMBL292617 0.77 AKT1 (0.41) AKT1AAK1
SCHEMBL292353 0.77 AKT1 (0.44) AKT1AAK1
SCHEMBL293844 0.77 AKT1 (0.47) AKT1AAK1
SCHEMBL291873 0.75 AKT1 (0.53) AKT1AAK1
SCHEMBL291187 0.74 AKT1 (0.50) AKT1
SCHEMBL15135598 0.73 AKT1 (0.39) AKT1AAK1KCNQ4KCNQ5KDM4D
SCHEMBL292274 0.72 AAK1 (0.39) AAK1KCNQ4KCNQ5KDM4D
SCHEMBL33525705 0.66 AAK1 (0.41) AAK1KCNQ4KCNQ5

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-8158790-B2 Cyclic amine compound DAIICHI SANKYO COMPANY, LIMITED (JP) 2012-04-17 US disclosed
EP-2036896-B1 CYCLIC AMINE COMPOUND DAIICHI SANKYO CO LTD (JP) 2012-03-14 EP disclosed
US-20090286807-A1 CYCLIC AMINE COMPOUND DAIICHI SANKYO COMPANY, LIMITED (JP) 2009-11-19 US disclosed
EP-2036896-A1 CYCLIC AMINE COMPOUND Daiichi Sankyo Company, Limited (JP) 2009-03-18 EP 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-20090286807-A1 CYCLIC AMINE COMPOUND HRH3, HRH4, H1-0 AKT1 2749/4885AAK1 3037/4885CDK9 3156/4885

“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.