SCHEMBL3873335

SCHEMBL3873335

NC(=O)OCC(NC(=O)[CH]CC(F)(F)Cc1ccccc1)C(=O)c1nc2ccccc2o1

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CMA1 P23946 3/20 0.38
FAAH O00519 1/20 0.38
CES1 P23141 1/20 0.38
DAGLA Q9Y4D2 1/20 0.38
XDH P47989 2/20 0.38
CTSS P25774 10/20 0.37
PRSS8 Q16651 2/20 0.35
KDM4E B2RXH2 1/20 0.35
RAB9A P51151 1/20 0.35
GLO1 Q04760 1/20 0.35
CYP3A4 P08684 1/20 0.34
CYP2C9 P11712 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
SCHEMBL3870014 0.89 FAAH (0.40) CMA1FAAHCES1DAGLAXDH
SCHEMBL5800404 0.85 CTSS (0.43) FAAHCES1DAGLACTSSCYP3A4
SCHEMBL5774425 0.76 DAGLA (0.43) FAAHCES1DAGLAXDHKDM4E
SCHEMBL3873339 0.76 CTSS (0.40) CMA1FAAHCES1DAGLAXDH
SCHEMBL3877756 0.75 CTSS (0.47) CTSSCYP3A4CYP2C9
SCHEMBL3873491 0.75 XDH (0.39) FAAHCES1DAGLAXDHKDM4E
SCHEMBL3870461 0.72 MMP1 (0.40) FAAHCES1RAB9A
SCHEMBL3869386 0.72 CTSS (0.35) CTSSRAB9A
SCHEMBL3872602 0.71 LIPG (0.32) CTSSKDM4ERAB9ACYP2C9
SCHEMBL3870369 0.70 CTSS (0.43) CMA1FAAHCES1DAGLACTSS

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-7482448-B2 Compounds and compositions as cathepsin inhibitors AVENTIS PHARMACEUTICALS INC. (US) 2009-01-27 US disclosed
US-20060189657-A1 Novel compounds and compositions as cathepsin inhibitors AVENTIS PHARMACEUTICALS INC. (US) 2006-08-24 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-20060189657-A1 Novel compounds and compositions as cathepsin inhibitors CTSB, CTSS, CTSK CMA1 19/4885FAAH 1034/4885CES1 251/4885

“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.