SCHEMBL7043385

SCHEMBL7043385

CC(C)(C)OC(=O)NC(CS(=O)(=O)Cc1ccccc1OC(F)F)C(=O)NC1(C(=O)c2nc3ccccc3o2)CCC1

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 14/20 0.35
SCN10A Q9Y5Y9 7/20 0.35
CYP3A4 P08684 7/20 0.35
CTSS P25774 2/20 0.33
CTSK P43235 2/20 0.33
EPHX2 P34913 1/20 0.33
MMP13 P45452 2/20 0.32
CACNA1B Q00975 1/20 0.32

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
SCHEMBL7042180 0.87 MAPT (0.40) SCN9ACYP3A4CTSSCTSKEPHX2
SCHEMBL7043390 0.85 SCN9A (0.31) SCN9ASCN10ACYP3A4EPHX2
SCHEMBL7043387 0.82 XDH (0.31)
SCHEMBL6061805 0.78 RAB9A (0.32) CTSS
SCHEMBL7044363 0.77 PPARG (0.49) SCN9ACYP3A4CTSSCTSKEPHX2
SCHEMBL6061798 0.77 RAB9A (0.32) CTSS
SCHEMBL6468723 0.76 THRB (0.31) CTSS
SCHEMBL6633837 0.74 CTSS (0.45) SCN9ACTSSCTSKMMP13CACNA1B
SCHEMBL6633834 0.74 CTSS (0.45) SCN9ACTSSCTSKMMP13CACNA1B
SCHEMBL6466324 0.74 CTSS (0.38) CYP3A4CTSSCTSKEPHX2

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-20030232864-A1 Novel Compounds and compositions as protease inhibitors AXYS PHARMACEUTICALS, INC. (US) 2003-12-18 US disclosed
US-6576630-B1 Alkanoyl substituted benzooxazoles or naphthooxazoles AXYS PHARMACEUTICALS, INC. 2003-06-10 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-20030232864-A1 Novel Compounds and compositions as protease inhibitors SERPINB1, CTRL, CTSZ SCN9A 2740/4885SCN10A 3158/4885CYP3A4 1183/4885

“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.