SCHEMBL3811481

SCHEMBL3811481

COc1ccc(Br)cc1S(=O)(=O)N(Cc1cc(F)ccc1F)[C@@H]1CCN(C#N)C1

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CTSL P07711 2/20 0.42
CTSB P07858 2/20 0.42
CTSS P25774 2/20 0.42
CTSK P43235 2/20 0.42
CTSC P53634 1/20 0.42
RORC P51449 4/20 0.41
TSHR P16473 2/20 0.41
KDM4E B2RXH2 1/20 0.39
USP30 Q70CQ3 1/20 0.39
GAA P10253 3/20 0.39
SMN1; SMN2 Q16637 2/20 0.38
ALOX15 P16050 1/20 0.38
ALDH1A1 P00352 1/20 0.38
P2RX7 Q99572 1/20 0.37
MCOLN3 Q8TDD5 1/20 0.37
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36

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 0.95 RORC (0.46) CTSLCTSBCTSSCTSKCTSC
SCHEMBL3808649 0.90 CTSL (0.42) CTSLCTSBCTSSCTSKCTSC
SCHEMBL3811330 0.90 CTSL (0.42) CTSLCTSBCTSSCTSKCTSC
SCHEMBL3806486 0.90 CTSL (0.53) CTSLCTSBCTSSCTSKCTSC
SCHEMBL3810395 0.89 RORC (0.40) CTSLCTSBCTSSCTSKCTSC
SCHEMBL3810169 0.88 CTSL (0.41) CTSLCTSBCTSSCTSKCTSC
SCHEMBL3808463 0.88 CTSL (0.42) CTSLCTSBCTSSCTSKCTSC
SCHEMBL3811104 0.87 CTSL (0.43) CTSLCTSBCTSSCTSKCTSC
SCHEMBL3806283 0.86 CTSL (0.40) CTSLCTSBCTSSCTSKCTSC
SCHEMBL3811257 0.86 CTSL (0.45) CTSLCTSBCTSSCTSKCTSC

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.