SCHEMBL3806572

SCHEMBL3806572

N#CN1CC[C@@H](N(Cc2ccc(F)cc2F)S(=O)(=O)c2cc(Br)ccc2Br)C1

nearest known ligand 0.48

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CTSL P07711 1/20 0.48
CTSB P07858 1/20 0.48
CTSS P25774 1/20 0.48
CTSK P43235 1/20 0.48
RORC P51449 16/20 0.47
USP30 Q70CQ3 3/20 0.40

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
SCHEMBL3810449 0.89 RORC (0.46) CTSLCTSBCTSSCTSKRORC
SCHEMBL3806244 0.83 CTSL (0.54) CTSLCTSBCTSSCTSKUSP30
SCHEMBL3810693 0.83 CTSL (0.46) CTSLCTSBCTSSCTSKRORC
SCHEMBL3811481 0.83 CTSL (0.42) CTSLCTSBCTSSCTSKRORC
SCHEMBL3811362 0.83 CTSL (0.46) CTSLCTSBCTSSCTSKRORC
SCHEMBL3811282 0.82 CTSL (0.49) CTSLCTSBCTSSCTSKRORC
SCHEMBL3808374 0.82 CTSL (0.49) CTSLCTSBCTSSCTSKRORC
SCHEMBL3810468 0.82 CTSL (0.49) CTSLCTSBCTSSCTSKRORC
SCHEMBL3811443 0.82 CTSL (0.53) CTSLCTSBCTSSCTSKUSP30
SCHEMBL3808370 0.80 CTSL (0.49) CTSLCTSBCTSSCTSKUSP30

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-20090264498-A1 Cathepsin C Inhibitors GLAXO GROUP LIMITED (GB) 2009-10-22 US claimed

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-20090264498-A1 Cathepsin C Inhibitors CTSF, CTSZ, CTSG CTSL 9/4885CTSB 4/4885CTSS 5/4885

“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.