SCHEMBL3319092

SCHEMBL3319092

CN(C)CCCn1cnc2c(N(N)C3CCCCC3)nc(C#N)nc21

nearest known ligand 0.48

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CTSL P07711 18/20 0.48
CTSB P07858 3/20 0.48
CTSK P43235 4/20 0.48
CTSS P25774 3/20 0.48

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
SCHEMBL8138108 0.99 CTSL (0.47) CTSLCTSBCTSKCTSS
SCHEMBL3318986 0.94 CTSL (0.52) CTSLCTSBCTSKCTSS
SCHEMBL3317671 0.93 CTSL (0.50) CTSLCTSBCTSKCTSS
Trifluoroacetic Acid SCHEMBL3319445 0.90 CTSL (0.41) CTSLCTSBCTSKCTSS
SCHEMBL8125449 0.85 TLR9 (0.43) CTSLCTSBCTSKCTSS
SCHEMBL3315752 0.83 CTSL (0.45) CTSLCTSBCTSKCTSS
SCHEMBL3318200 0.82 CTSL (0.43) CTSLCTSBCTSKCTSS
SCHEMBL4428152 0.80 CTSL (0.40) CTSLCTSBCTSKCTSS
SCHEMBL8139151 0.80 CTSL (0.50) CTSLCTSBCTSKCTSS
SCHEMBL4428147 0.80 CTSL (0.40) CTSLCTSBCTSKCTSS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100105652-A1 PURINES AS CYSTEINE PROTEASE INHIBITORS GLAXO GROUP LIMITED 2010-04-29 US disclosed
US-20100105652-A1 PURINES AS CYSTEINE PROTEASE INHIBITORS GLAXO GROUP LIMITED 2010-04-29 US disclosed
US-20100105652-A1 PURINES AS CYSTEINE PROTEASE INHIBITORS GLAXO GROUP LIMITED 2010-04-29 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-20100105652-A1 PURINES AS CYSTEINE PROTEASE INHIBITORS CPN1, SERPINB1, PNP CTSL 31/4885CTSB 111/4885CTSK 135/4885

“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.