SCHEMBL12899861

SCHEMBL12899861

Nc1ccnc(Oc2nc(C(=O)Nc3ccccc3N3CCC(N)CC3)cs2)c1

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ CHEK1 O14757 17/20 0.47
▸ PIM1 P11309 2/20 0.47
▸ PIM3 Q86V86 2/20 0.47
▸ PIM2 Q9P1W9 2/20 0.47
▸ PRKCA P17252 1/20 0.47
▸ GSK3B P49841 1/20 0.47
▸ PRKCQ Q04759 1/20 0.47

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
SCHEMBL14206376 0.82 CHEK1 (0.60) CHEK1PIM1PIM3PIM2
SCHEMBL12899858 0.82 PIM1 (0.47) CHEK1PIM1PIM3PIM2PRKCA
SCHEMBL19311924 0.81 PIM1 (0.36) PIM1PIM3PIM2
SCHEMBL14207423 0.79 PIM1 (0.56) CHEK1PIM1PIM3PIM2PRKCA
SCHEMBL14206744 0.78 CHEK1 (0.58) CHEK1PIM1PIM3PIM2PRKCA
SCHEMBL11886272 0.76 CHEK1 (0.58) CHEK1PIM1PIM3PIM2PRKCA
SCHEMBL14038952 0.76 CHEK1 (0.51) CHEK1PIM1PIM3PIM2PRKCA
SCHEMBL11886249 0.74 CHEK1 (0.66) CHEK1PIM1PIM3PIM2PRKCA
SCHEMBL12899919 0.74 PIM1 (0.48) CHEK1PIM1PIM3PIM2PRKCA
SCHEMBL14207411 0.73 CHEK1 (0.75) CHEK1PIM1PIM3PIM2

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-2225235-B1 THIAZOLE CARBOXAMIDE DERIVATIVES AND THEIR USE TO TREAT CANCER MERCK SHARP & DOHME (US) 2017-09-06 — — EP disclosed
US-8394960-B2 Thiazole carboxamide derivatives and their use to treat cancer MERCK SHARP & DOHME CORP. (US) 2013-03-12 — — US disclosed
US-8394960-B2 Thiazole carboxamide derivatives and their use to treat cancer MERCK SHARP & DOHME CORP. (US) 2013-03-12 — — US disclosed
US-20110044940-A1 Thiazole Carboxamide Derivatives and Their Use to Treat Cancer SCHERING CORPORATION 2011-02-24 — — US disclosed
US-20110044940-A1 Thiazole Carboxamide Derivatives and Their Use to Treat Cancer SCHERING CORPORATION 2011-02-24 — — US disclosed
WO-2009058729-A2 THIAZOLE CARBOXAMIDE DERIVATIVES AND THEIR TO TREAT CANCER SCHERING CORPORATION (US) 2009-05-07 — — 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-20110044940-A1 Thiazole Carboxamide Derivatives and Their Use to Treat Cancer LCK, TEC, MTOR CHEK1 186/4885PIM1 1181/4885PIM3 1244/4885

“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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