SCHEMBL4903584

SCHEMBL4903584

C=CCOc1ccc(C(Nc2ccc(C(=N)N)cc2)C(=O)NNc2ccccc2C(=O)OC(=O)C(F)(F)F)cc1OCC=C

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
F7 P08709 17/20 0.47
F2 P00734 11/20 0.47
F10 P00742 10/20 0.47
PRSS1 P07477 10/20 0.47
F3 P13726 5/20 0.46
PRSS2 P07478 3/20 0.46
PRSS3 P35030 3/20 0.46
KLK1 P06870 1/20 0.31
KLK5 Q9Y337 1/20 0.31
F9 P00740 1/20 0.31

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
SCHEMBL4914847 0.90 F7 (0.59) F7F2F10PRSS1F3
Trifluoroacetic Acid SCHEMBL4903571 0.90 F7 (0.50) F7F2F10PRSS1F3
SCHEMBL13162226 0.88 F7 (0.54) F7F2F10PRSS1F3
SCHEMBL3463929 0.87 F7 (0.53) F7F2F10PRSS1F3
SCHEMBL3463461 0.86 F7 (0.54) F7F2F10PRSS1F3
SCHEMBL3463526 0.86 F7 (0.54) F7F2F10PRSS1F3
SCHEMBL3464697 0.86 F7 (0.56) F7F2F10PRSS1F3
SCHEMBL3464246 0.86 F7 (0.60) F7F2F10PRSS1F3
SCHEMBL3463229 0.85 F7 (0.51) F7F2F10PRSS1F3
SCHEMBL3463827 0.84 F7 (0.44) F7F2F10PRSS1F3

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-20080132507-A1 Hydrazide Derivatives EISAI R&D MANAGEMENT CO., LTD. (JP) 2008-06-05 US disclosed
EP-1810965-A1 HYDRAZIDE DERIVATIVES Eisai R&D Management Co., Ltd. (JP) 2007-07-25 EP 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-20080132507-A1 Hydrazide Derivatives H1-10, H1-4, H1-3 F7 185/4885F2 19/4885F10 11/4885

“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.