SCHEMBL12506934

SCHEMBL12506934

Fc1c(-c2nnc(NCc3cccc(C(F)(F)F)c3)o2)ccc2[nH]ncc12

nearest known ligand 0.57

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ TDO2 P48775 7/20 0.57
▸ CDC7 O00311 6/20 0.48
▸ CCNE1 P24864 6/20 0.48
▸ CDK2 P24941 6/20 0.48
▸ DBF4 Q9UBU7 6/20 0.48
▸ KDR P35968 5/20 0.47
▸ TRPA1 O75762 1/20 0.43
▸ IDO1 P14902 1/20 0.40
▸ FLT1 P17948 3/20 0.39
▸ BRD4 O60885 1/20 0.38

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
SCHEMBL12506922 0.88 CDC7 (0.56) TDO2CDC7CCNE1CDK2DBF4
SCHEMBL2190120 0.84 CDC7 (0.47) CDC7CCNE1CDK2DBF4
SCHEMBL12506943 0.81 CDC7 (0.74) TDO2CDC7CCNE1CDK2DBF4
SCHEMBL12507122 0.79 CDC7 (0.43) CDC7CCNE1CDK2DBF4KDR
SCHEMBL19249092 0.73 TDO2 (1.00) TDO2IDO1
SCHEMBL2189331 0.73 CDC7 (0.47) CDC7CCNE1CDK2DBF4
SCHEMBL12507115 0.69 CDC7 (0.42) CDC7CCNE1CDK2DBF4TRPA1
SCHEMBL13122375 0.69 ROCK2 (0.61) TDO2CDK2KDR
SCHEMBL28673206 0.68 TDO2 (0.81) TDO2IDO1BRD4
SCHEMBL19249001 0.68 TDO2 (0.81) TDO2IDO1

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 TDO2 1623/4885CDC7 711/4885CCNE1 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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