SCHEMBL12507110

SCHEMBL12507110

C[C@H](Nc1nnc(-c2ccc3[nH]ncc3c2)o1)c1ccc(Cl)c(Cl)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CDC7 O00311 3/20 0.51
▸ CDK2 P24941 3/20 0.51
▸ CCNE1 P24864 1/20 0.51
▸ DBF4 Q9UBU7 1/20 0.51
▸ PIM1 P11309 10/20 0.45
▸ PIM2 Q9P1W9 7/20 0.45
▸ PIM3 Q86V86 5/20 0.45
▸ CLK2 P49760 4/20 0.42
▸ DYRK1A Q13627 4/20 0.42
▸ CLK4 Q9HAZ1 4/20 0.42
▸ ROCK2 O75116 4/20 0.42
▸ AKT1 P31749 3/20 0.42
▸ GSK3B P49841 3/20 0.42
▸ KDR P35968 2/20 0.42
▸ MAPK13 O15264 2/20 0.42
▸ DAPK3 O43293 2/20 0.42
▸ DYRK3 O43781 2/20 0.42
▸ RPS6KA5 O75582 2/20 0.42
▸ PRKD3 O94806 2/20 0.42
▸ MAP4K4 O95819 2/20 0.42

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
SCHEMBL12507095 1.00 CDC7 (0.51) CDC7CDK2CCNE1DBF4PIM1
SCHEMBL2190058 0.91 CDC7 (0.48) CDC7CDK2CCNE1DBF4PIM1
SCHEMBL12506927 0.83 CDC7 (0.53) CDC7CDK2CCNE1DBF4PIM1
SCHEMBL12507128 0.83 CDC7 (0.53) CDC7CDK2CCNE1DBF4PIM1
SCHEMBL12506948 0.81 CDC7 (0.51) CDC7CDK2CCNE1DBF4PIM1
SCHEMBL12507104 0.81 CDC7 (0.53) CDC7CDK2CCNE1DBF4PIM1
SCHEMBL12506947 0.81 CDC7 (0.53) CDC7CDK2CCNE1DBF4PIM1
SCHEMBL12507126 0.78 ATR (0.38) CDC7CDK2CCNE1DBF4PIM1
SCHEMBL12507238 0.75 RPS6KB1 (0.42) CDC7CDK2CCNE1DBF4PIM1
SCHEMBL12506930 0.75 RPS6KB1 (0.42) CDC7CDK2CCNE1DBF4PIM1

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
EP-2102197-B1 5-([1,3,4]OXADIAZOL-2-YL)-1H-INDAZOL AND 5-([1,3,4]THIADIAZOL-2-YL)-1H-INDAZOL DERIVATIVES AS SGK INHIBITORS FOR THE TREATMENT OF DIABETES MERCK PATENT GMBH (DE) 2011-07-13 — — EP disclosed
US-20100063115-A1 5-(1,3,4-OXADIAZOL-2-YL)-1H-INDAZOLE AND 5-(1,3,4-THIADIAZOL-2-YL)-1H-INDAZOLE DERIVATIVES AS SGK INHIBITORS FOR THE TREATMENT OF DIABETES MERCK PATENT GESELLSCHAFT (DE) 2010-03-11 — — US disclosed
US-20100063115-A1 5-(1,3,4-OXADIAZOL-2-YL)-1H-INDAZOLE AND 5-(1,3,4-THIADIAZOL-2-YL)-1H-INDAZOLE DERIVATIVES AS SGK INHIBITORS FOR THE TREATMENT OF DIABETES MERCK PATENT GESELLSCHAFT (DE) 2010-03-11 — — US disclosed
WO-2008086854-A1 5-([1,3,4] OXADIAZOL-2-YL)-1H-INDAZOL AND 5-([1,3,4] THIADIAZOL-2-YL)-1H-INDAZOL DERIVATIVES AS SGK INHIBITORS FOR THE TREATMENT OF DIABETES MERCK PATENT GMBH (DE) 2008-07-24 — — 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-20100063115-A1 5-(1,3,4-OXADIAZOL-2-YL)-1H-INDAZOLE AND 5-(1,3,4-THIADIAZOL-2-YL)-1H-INDAZOLE DERIVATIVES AS SGK INHIBITORS FOR THE TREATMENT OF DIABETES SGK2, SGK1, SGK3 CDC7 711/4885CDK2 445/4885CCNE1 888/4885

“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.

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