SCHEMBL14930707

SCHEMBL14930707

COC(=O)N[C@@H](CCN)C(=O)C(C)(C)C

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ GABRR1 P24046 2/20 0.31
▸ CTSK P43235 3/20 0.31
▸ CTSS P25774 2/20 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
SCHEMBL17339719 0.90 CTSK (0.35) CTSKCTSS
SCHEMBL14930711 0.88 FOLH1 (0.40) CTSK
SCHEMBL12598695 0.84 CTSK (0.44) CTSKCTSS
SCHEMBL8907753 0.82 CTSK (0.31) CTSKCTSS
SCHEMBL2628236 0.79 GABRR1 (0.43) GABRR1
SCHEMBL14932839 0.79 GABRR1 (0.34) GABRR1
SCHEMBL8906526 0.79 CTSK (0.41) CTSKCTSS
SCHEMBL19318522 0.79 TGFBR1 (0.40) CTSKCTSS
SCHEMBL8906540 0.79 CTSK (0.41) CTSKCTSS
SCHEMBL13223941 0.79 TGFBR1 (0.40) CTSKCTSS

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-9669027-B2 Hepatitis C virus inhibitors THERAVANCE BIOPHARMA R&D IP, LLC (US) 2017-06-06 — — US disclosed
US-20160038483-A1 HEPATITIS C VIRUS INHIBITORS THERAVANCE BIOPHARMA R&D IP, LLC (US) 2016-02-11 — — US disclosed
US-9212168-B2 Hepatitis C virus inhibitors THERAVANCE BIOPHARMA R&D IP, LLC (US) 2015-12-15 — — US disclosed
US-20130115194-A1 HEPATITIS C VIRUS INHIBITORS THERAVANCE BIOPHARMA R&D IP, LLC 2013-05-09 — — 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 (2 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-20130115194-A1 HEPATITIS C VIRUS INHIBITORS HAVCR2, SLC10A1, HDGF GABRR1 3768/4885CTSK 2116/4885CTSS 917/4885
US-20160038483-A1 HEPATITIS C VIRUS INHIBITORS HAVCR2, SLC10A1, HDGF GABRR1 3768/4885CTSK 2116/4885CTSS 917/4885

“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.

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