SCHEMBL16247286

SCHEMBL16247286

CCc1c(N)ncnc1N1CCC(c2nc(-c3ccc(F)c(C(F)(F)F)c3)cn2CCN2CCC2)CC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
AKT1 P31749 20/20 1.00
RPS6KB1 P23443 19/20 1.00
AKT2 P31751 3/20 1.00
KCNH2 Q12809 3/20 1.00
AKT3 Q9Y243 3/20 1.00

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
SCHEMBL14791928 0.98 RPS6KB1 (1.00) AKT1RPS6KB1AKT2KCNH2AKT3
SCHEMBL14792293 0.98 RPS6KB1 (1.00) AKT1RPS6KB1AKT2KCNH2AKT3
SCHEMBL14792311 0.93 RPS6KB1 (1.00) AKT1RPS6KB1AKT2KCNH2AKT3
SCHEMBL14782403 0.93 AKT1 (1.00) AKT1RPS6KB1AKT2KCNH2AKT3
SCHEMBL16247287 0.93 RPS6KB1 (1.00) AKT1RPS6KB1AKT2KCNH2AKT3
SCHEMBL14782538 0.92 RPS6KB1 (1.00) AKT1RPS6KB1AKT2KCNH2AKT3
SCHEMBL14786538 0.92 RPS6KB1 (1.00) AKT1RPS6KB1AKT2KCNH2AKT3
SCHEMBL16247296 0.92 RPS6KB1 (1.00) AKT1RPS6KB1AKT2KCNH2AKT3
SCHEMBL16247297 0.91 AKT1 (1.00) AKT1RPS6KB1AKT2KCNH2AKT3
SCHEMBL16987133 0.90 RPS6KB1 (0.97) AKT1RPS6KB1AKT2KCNH2AKT3

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2970201-B1 6-[4-(1H-IMIDAZOL-2-YL)PIPERIDIN-1-YL]PYRIMIDIN-4-AMINE DERIVATIVES AS MODULATORS OF KINASE ACTIVITY MERCK PATENT GMBH (DE) 2019-06-19 EP disclosed
EP-2755965-B1 NOVEL IMIDAZOLE AMINES AS MODULATORS OF KINASE ACTIVITY MERCK PATENT GMBH (DE) 2017-07-26 EP disclosed
US-20160000785-A1 Novel Imidazole Amines as Modulators of Kinase Activity MERCK PATENT GMBH (DE) 2016-01-07 US disclosed
US-20160000785-A1 Novel Imidazole Amines as Modulators of Kinase Activity MERCK PATENT GMBH (DE) 2016-01-07 US disclosed
US-9145392-B2 Imidazole amines as modulators of kinase activity MERCK PATENT GMBH (DE) 2015-09-29 US disclosed
US-9145392-B2 Imidazole amines as modulators of kinase activity MERCK PATENT GMBH (DE) 2015-09-29 US disclosed
US-20140343029-A1 Novel Imidazole Amines as Modulators of Kinase Activity MERCK PATENT GMBH (DE) 2014-11-20 US disclosed
US-20140343029-A1 Novel Imidazole Amines as Modulators of Kinase Activity MERCK PATENT GMBH (DE) 2014-11-20 US 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-20160000785-A1 Novel Imidazole Amines as Modulators of Kinase Activity MAP3K11, MAP3K20, MAP3K19 AKT1 291/4885RPS6KB1 271/4885AKT2 383/4885
US-20140343029-A1 Novel Imidazole Amines as Modulators of Kinase Activity MAP3K11, MAP3K20, MAP3K19 AKT1 291/4885RPS6KB1 271/4885AKT2 383/4885

“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.