SCHEMBL13336056

SCHEMBL13336056

Cn1cc(-c2cc(Nc3ncc4cc(Br)cc(Cl)c4n3)cc(O[C@@H]3CCNC3)c2)cn1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CHEK1 O14757 10/20 0.47
▸ JAK2 O60674 2/20 0.46
▸ JAK1 P23458 2/20 0.46
▸ TYK2 P29597 2/20 0.46
▸ JAK3 P52333 2/20 0.46
▸ CHEK2 O96017 2/20 0.43
▸ LCK P06239 2/20 0.43
▸ LYN P07948 2/20 0.43
▸ PIM1 P11309 2/20 0.43
▸ RPS6KB1 P23443 2/20 0.43
▸ FLT3 P36888 2/20 0.43
▸ BLK P51451 2/20 0.43
▸ PRKAG1 P54619 2/20 0.43
▸ PRKAA1 Q13131 2/20 0.43
▸ PIM3 Q86V86 2/20 0.43
▸ PRKAB1 Q9Y478 2/20 0.43
▸ MET P08581 1/20 0.39
▸ SYK P43405 1/20 0.39
▸ AXL P30530 1/20 0.39
▸ TYRO3 Q06418 1/20 0.39

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
SCHEMBL13336133 1.00 CHEK1 (0.47) CHEK1JAK2JAK1TYK2JAK3
SCHEMBL13336063 0.93 CHEK1 (0.48) CHEK1JAK2JAK1TYK2JAK3
SCHEMBL13336122 0.91 CHEK1 (0.47) CHEK1JAK2JAK1TYK2JAK3
SCHEMBL13336204 0.91 JAK1 (0.49) CHEK1JAK2JAK1TYK2JAK3
SCHEMBL13362915 0.91 JAK1 (0.49) CHEK1JAK2JAK1TYK2JAK3
SCHEMBL13336059 0.90 CHEK1 (0.47) CHEK1JAK2JAK1TYK2JAK3
SCHEMBL13336139 0.90 CHEK1 (0.47) CHEK1JAK2JAK1TYK2JAK3
SCHEMBL13336141 0.89 CHEK1 (0.53) CHEK1JAK2JAK1TYK2JAK3
SCHEMBL13336068 0.89 CHEK1 (0.53) CHEK1JAK2JAK1TYK2JAK3
SCHEMBL13336135 0.88 CHEK1 (0.47) CHEK1JAK2JAK1TYK2JAK3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100121052-A1 Novel compounds for treating proliferative diseases JAIN RAMA 2010-05-13 — — US disclosed
WO-2009153313-A1 2 -ARYLAMINOQUINAZOLINES FOR TREATING PROLIFERATIVE DISEASES NOVARTIS AG (CH) 2009-12-23 — — 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-20100121052-A1 Novel compounds for treating proliferative diseases PDK1, PDK2, PDK3 CHEK1 320/4885JAK2 1056/4885JAK1 1597/4885

“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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