SCHEMBL17615416

SCHEMBL17615416

CC(C)(F)C[C@H](N[C@@H](c1ccc(-c2ccc(S(C)(=O)=O)cc2)cc1)C(F)(F)F)C(=O)NC1(C)CC1

nearest known ligand 0.76

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CTSK P43235 15/20 0.76
CTSB P07858 8/20 0.76
CTSL P07711 7/20 0.76
CTSF Q9UBX1 6/20 0.76
CTSS P25774 3/20 0.76
CTSV O60911 1/20 0.76

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
SCHEMBL8117533 0.90 CTSK (0.76) CTSKCTSBCTSLCTSFCTSS
SCHEMBL16020393 0.88 CTSK (0.60) CTSKCTSBCTSLCTSFCTSS
SCHEMBL15977393 0.88 CTSK (0.61) CTSKCTSBCTSLCTSFCTSS
Odanacatib SCHEMBL18540595 0.87 CTSK (1.00) CTSKCTSBCTSLCTSFCTSS
SCHEMBL22733917 0.87 CTSK (0.83) CTSKCTSBCTSLCTSFCTSS
SCHEMBL22733918 0.87 CTSK (0.83) CTSKCTSBCTSLCTSFCTSS
Odanacatib SCHEMBL1496266 0.87 CTSK (1.00) CTSKCTSBCTSLCTSFCTSS
Odanacatib SCHEMBL15827397 0.87 CTSK (1.00) CTSKCTSBCTSLCTSFCTSS
SCHEMBL15894170 0.87 CTSK (0.83) CTSKCTSBCTSLCTSFCTSS
Odanacatib SCHEMBL3479347 0.87 CTSK (1.00) CTSKCTSBCTSLCTSFCTSS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160081937-A1 TABLET WITH INCREASED DRUG LOAD OF ODANACATIB HEXAL AG (DE) 2016-03-24 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-20160081937-A1 TABLET WITH INCREASED DRUG LOAD OF ODANACATIB OSTC, SLCO1B3, SLCO1B1 CTSK 3029/4885CTSB 956/4885CTSL 3150/4885

“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.