SCHEMBL15720179

SCHEMBL15720179

Cc1cccc(-c2cn(CCN(C)C)c(C3CCNCC3)n2)c1

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 1/20 0.44
GABRB2 P47870 1/20 0.44
RPS6KB1 P23443 14/20 0.44
AKT1 P31749 14/20 0.44
HTR2C P28335 2/20 0.43
MAPK14 Q16539 1/20 0.43
RPS6KA1 Q15418 1/20 0.42
TLR8 Q9NR97 1/20 0.42
AKT2 P31751 5/20 0.41
KCNH2 Q12809 5/20 0.41
AKT3 Q9Y243 5/20 0.41

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
SCHEMBL15720111 0.88 RPS6KB1 (0.46) RPS6KB1AKT1RPS6KA1TLR8AKT2
SCHEMBL15719892 0.88 RPS6KB1 (0.41) GABRA1GABRB2RPS6KB1AKT1RPS6KA1
Hydrochloric Acid SCHEMBL11903905 0.88 RPS6KB1 (0.46) RPS6KB1AKT1RPS6KA1TLR8AKT2
Hydrochloric Acid SCHEMBL11904052 0.87 RPS6KB1 (0.41) GABRA1GABRB2RPS6KB1AKT1RPS6KA1
SCHEMBL15720777 0.87 RPS6KB1 (0.45) GABRA1GABRB2RPS6KB1AKT1RPS6KA1
SCHEMBL15720450 0.87 HTR2C (0.46) RPS6KB1AKT1HTR2CRPS6KA1TLR8
Hydrochloric Acid SCHEMBL11904101 0.85 MEN1 (0.49) RPS6KB1AKT1HTR2CRPS6KA1TLR8
SCHEMBL17023911 0.84 RPS6KB1 (0.51) RPS6KB1AKT1
SCHEMBL15719613 0.83 AKT1 (0.61) RPS6KB1AKT1AKT2KCNH2AKT3
SCHEMBL17023907 0.83 HTR1D (0.45) GABRA1RPS6KB1AKT1RPS6KA1TLR8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3299362-B1 IMIDAZOL-PIPERIDINYL DERIVATIVES AS MODULATORS OF KINASE ACTIVITY MERCK PATENT GMBH (DE) 2020-04-22 EP disclosed
EP-3299362-A1 IMIDAZOL-PIPERIDINYL DERIVATIVES AS MODULATORS OF KINASE ACTIVITY Merck Patent GmbH (DE) 2018-03-28 EP disclosed
US-9315517-B2 Imidazol-piperidinyl derivatives as modulators of kinase activity MERCK PATENT GMBH (DE) 2016-04-19 US disclosed
EP-2920154-A1 NOVEL IMIDAZOL-PIPERIDINYL DERIVATIVES AS MODULATORS OF KINASE ACTIVITY Merck Patent GmbH (DE) 2015-09-23 EP disclosed
US-20150239902-A1 Novel Imidazol-piperidinyl Derivatives as Modulators of Kinase Activity MERCK PATENT GMBH (DE) 2015-08-27 US disclosed
WO-2014078634-A1 NOVEL IMIDAZOL-PIPERIDINYL DERIVATIVES AS MODULATORS OF KINASE ACTIVITY MERCK PATENT GMBH (DE) 2014-05-22 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-20150239902-A1 Novel Imidazol-piperidinyl Derivatives as Modulators of Kinase Activity MAP4K2, MAP4K3, MAP3K4 GABRA1 3198/4885GABRB2 2991/4885RPS6KB1 318/4885

“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.