SCHEMBL3890749

SCHEMBL3890749

CCOC(=O)Cc1c(C#N)ccc(N(CC(F)(F)c2cccc(C)[n+]2[O-])C(=O)C(F)(F)F)c1F

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
F2 P00734 1/20 0.32
KDM4E B2RXH2 1/20 0.30
CYP2C9 P11712 1/20 0.30

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
SCHEMBL13792116 0.84 F2 (0.44) F2
SCHEMBL5773458 0.80 F2 (0.38) F2KDM4ECYP2C9
SCHEMBL3886853 0.79 F2 (0.44) F2KDM4ECYP2C9
SCHEMBL5773454 0.76 KDM4E (0.33) KDM4ECYP2C9
SCHEMBL3889737 0.69 F2 (0.51) F2
SCHEMBL3888694 0.67 KDM4E (0.45) KDM4ECYP2C9
SCHEMBL31682816 0.64 KDM4E (0.40) KDM4E
SCHEMBL3888182 0.62 F2 (0.66) F2KDM4ECYP2C9
SCHEMBL3888296 0.62 F2 (0.61) F2
SCHEMBL3888247 0.62 F2 (0.64) F2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7550474-B2 Substituted phenyl acetamides and their use as protease inhibitors JOHNSON & JOHNSON PHARMACEUTICALS RESEARCH & DEVELOPMENT, L.L.C. (US) 2009-06-23 US disclosed
US-7550474-B2 Substituted phenyl acetamides and their use as protease inhibitors JOHNSON & JOHNSON PHARMACEUTICALS RESEARCH & DEVELOPMENT, L.L.C. (US) 2009-06-23 US disclosed
EP-1613319-B1 SUBSTITUTED PHENYL ACETAMIDES AND THEIR USE AS PROTEASE INHIBITORS ORTHO MCNEIL PHARM INC (US) 2009-06-03 EP disclosed
US-20040254166-A1 Substituted phenyl acetamides and their use as protease inhibitors JOHNSON & JOHNSON PHARMACEUTICAL RESEARCH & DEVELOPMENT, L.L.C. 2004-12-16 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-20040254166-A1 Substituted phenyl acetamides and their use as protease inhibitors TFPI, F12, SPINT2 F2 13/4885KDM4E 2158/4885CYP2C9 1049/4885

“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.