SCHEMBL13156190

SCHEMBL13156190

O=C(Nc1cnccc1N1CCNCC1)c1csc(N2Cc3c(Cl)cccc3C2=O)n1

nearest known ligand 0.78

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ CHEK1 O14757 20/20 0.78
▸ JAK2 O60674 1/20 0.67
▸ ROCK2 O75116 1/20 0.67
▸ IGF1R P08069 1/20 0.67
▸ MAPK1 P28482 1/20 0.67
▸ AKT1 P31749 1/20 0.67
▸ RPS6KA3 P51812 1/20 0.67
▸ NEK2 P51955 1/20 0.67
▸ STK3 Q13188 1/20 0.67
▸ CAMK4 Q16566 1/20 0.67
▸ TSSK2 Q96PF2 1/20 0.67
▸ IRAK4 Q9NWZ3 1/20 0.67

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
SCHEMBL14216580 0.92 CHEK1 (0.67) CHEK1JAK2ROCK2IGF1RMAPK1
SCHEMBL13156187 0.89 CHEK1 (0.74) CHEK1JAK2ROCK2IGF1RMAPK1
SCHEMBL13156217 0.88 CHEK1 (1.00) CHEK1JAK2ROCK2IGF1RMAPK1
SCHEMBL13028168 0.88 CHEK1 (0.59) CHEK1JAK2ROCK2IGF1RMAPK1
SCHEMBL13156185 0.87 CHEK1 (0.78) CHEK1JAK2ROCK2IGF1RMAPK1
SCHEMBL11924203 0.86 CHEK1 (0.58) CHEK1JAK2ROCK2IGF1RMAPK1
SCHEMBL13156183 0.84 CHEK1 (0.81) CHEK1JAK2ROCK2IGF1RMAPK1
SCHEMBL13156213 0.84 CHEK1 (0.86) CHEK1JAK2ROCK2IGF1RMAPK1
SCHEMBL11923918 0.83 CHEK1 (0.54) CHEK1JAK2ROCK2IGF1RMAPK1
SCHEMBL13156192 0.82 CHEK1 (0.81) CHEK1JAK2ROCK2IGF1RMAPK1

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-2078004-B1 2-AMINOTHIAZOLE-4-CARBOXYLIC AMIDES AS PROTEIN KINASE INHIBITORS MERCK SHARP & DOHME (US) 2015-02-25 — — EP disclosed
US-8318735-B2 2-aminothiazole-4-carboxylic amides as protein kinase inhibitors MERCK SHARP & DOHME CORP. (US) 2012-11-27 — — US disclosed
US-8318735-B2 2-aminothiazole-4-carboxylic amides as protein kinase inhibitors MERCK SHARP & DOHME CORP. (US) 2012-11-27 — — US disclosed
US-20100249030-A1 ANTI-MITOTIC AGENT AND AURORA KINASE INHIBITOR COMBINATION AS ANTI-CANCER TREATMENT SCHERING CORPORATION 2010-09-30 — — US disclosed
US-20100130465-A1 2-AMINOTHIAZOLE-4-CARBOXYLIC AMIDES AS PROTEIN KINASE INHIBITORS MERCK SHARP & DOHME LLC 2010-05-27 — — US disclosed
US-20100130465-A1 2-AMINOTHIAZOLE-4-CARBOXYLIC AMIDES AS PROTEIN KINASE INHIBITORS MERCK SHARP & DOHME LLC 2010-05-27 — — US disclosed
WO-2009017701-A2 ANTI-MITOTIC AGENT AND AURORA KINASE INHIBITOR COMBINATION AS ANTI-CANCER TREATMENT SCHERING CORPORATION (US) 2009-02-05 — — WO disclosed
WO-2008054749-A1 2-AMINOTHIAZOLE-4-CARBOXYLIC AMIDES AS PROTEIN KINASE INHIBITORS SCHERING CORPORATION (US) 2008-05-08 — — 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 (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-20100249030-A1 ANTI-MITOTIC AGENT AND AURORA KINASE INHIBITOR COMBINATION AS ANTI-CANCER TREATMENT AURKC, AURKA, AURKB CHEK1 61/4885JAK2 2406/4885ROCK2 390/4885
US-20100130465-A1 2-AMINOTHIAZOLE-4-CARBOXYLIC AMIDES AS PROTEIN KINASE INHIBITORS MAPK15, CDK15, MAP3K15 CHEK1 395/4885JAK2 42/4885ROCK2 794/4885

“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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