SCHEMBL4409485

SCHEMBL4409485

CCOC(=O)C(C#N)C1(c2ccc(F)c(C)c2)CCN(C(=O)OC(C)(C)C)CC1

nearest known ligand 0.44

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 18/20 0.44
JAK1 P23458 18/20 0.44
GPR119 Q8TDV5 1/20 0.42
DPP4 P27487 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
SCHEMBL4413039 0.94 JAK2 (0.47) JAK2JAK1GPR119DPP4
SCHEMBL3523465 0.92 JAK2 (0.42) JAK2JAK1GPR119
SCHEMBL4407208 0.92 JAK2 (0.41) JAK2JAK1
SCHEMBL3525497 0.89 GPR119 (0.41) JAK2JAK1GPR119DPP4
SCHEMBL14272848 0.89 JAK2 (0.40) JAK2JAK1
SCHEMBL4405768 0.89 JAK2 (0.47) JAK2JAK1
SCHEMBL5916161 0.87 GPR119 (0.45) JAK2JAK1GPR119
SCHEMBL16554255 0.87 MEN1 (0.44) JAK2JAK1
SCHEMBL3530835 0.86 GPR119 (0.42) JAK2JAK1GPR119
SCHEMBL3523742 0.85 TP53 (0.46) JAK2JAK1

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
EP-1558577-B1 SUBSTITUTED 4-PHENYL-PIPERIDIN-AMIDES AS TACHYKININ ANTAGONISTS AND SEROTONIN REPTAKE INHIBITORS GLAXO GROUP LTD (GB) 2009-12-30 EP disclosed
US-20060128752-A1 Chemical compounds GLAXO GROUP LIMITED (GB) 2006-06-15 US 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-20060128752-A1 Chemical compounds HTR7, NPSR1, TACR2 JAK2 1826/4885JAK1 3006/4885GPR119 125/4885

“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.