SCHEMBL14429623

SCHEMBL14429623

CN(CCc1cccnc1)C(=O)c1ccc(N2CCC(NC(=O)OC(C)(C)C)C2=O)c(F)c1

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 1/20 0.43
F10 P00742 4/20 0.39
NPY5R Q15761 5/20 0.38
JAK1 P23458 3/20 0.37
ROCK2 O75116 2/20 0.37
CHRNB2 P17787 1/20 0.36
CHRNA7 P36544 1/20 0.36
CHRNA4 P43681 1/20 0.36
PDK1 Q15118 2/20 0.35
PDK2 Q15119 2/20 0.35
PDK3 Q15120 2/20 0.35
PDK4 Q16654 2/20 0.35
JAK2 O60674 1/20 0.35
TBXAS1 P24557 2/20 0.35
ROCK1 Q13464 1/20 0.34

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
SCHEMBL14429625 0.85 F10 (0.44) F10PDK1PDK2PDK3PDK4
SCHEMBL14429624 0.83 F10 (0.39) F10ROCK2PDK1PDK2PDK3
SCHEMBL14269343 0.81 F10 (0.53) F10
SCHEMBL5459404 0.81 NAMPT (0.45) NAMPTF10JAK1ROCK2PDK1
SCHEMBL5459134 0.77 F10 (0.44) F10
SCHEMBL8298724 0.77 F10 (0.51) F10
SCHEMBL5710344 0.77 F10 (0.44) F10
SCHEMBL5459180 0.77 F10 (0.72) F10
SCHEMBL5459186 0.77 F10 (0.72) F10
SCHEMBL4858641 0.76 SRD5A1 (0.43) F10

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-20070203206-A1 2-Pyrrolidone Derivatives And Use Thereof As Factor Xa Inhibitors GLAXO GROUP LIMITED (GB) 2007-08-30 US disclosed
US-20070203206-A1 2-Pyrrolidone Derivatives And Use Thereof As Factor Xa Inhibitors GLAXO GROUP LIMITED (GB) 2007-08-30 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-20070203206-A1 2-Pyrrolidone Derivatives And Use Thereof As Factor Xa Inhibitors TFPI, F2, F12 NAMPT 614/4885F10 13/4885NPY5R 858/4885

“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.