SCHEMBL6461875

SCHEMBL6461875

CON(C)C(=O)C(CCc1ccccc1)NC(=O)C(CC(C)C)NC(=O)OCc1ccccc1

nearest known ligand 0.63

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CTSL P07711 7/20 0.63
CTSK P43235 7/20 0.60
CTSB P07858 3/20 0.58
CAPN1 P07384 2/20 0.57
CTSS P25774 3/20 0.57
MMP1 P03956 1/20 0.56
MMP3 P08254 1/20 0.56

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
SCHEMBL7134291 0.93 CTSL (0.58) CTSLCTSKCTSBCAPN1CTSS
SCHEMBL1701577 0.91 CTSL (0.55) CTSLCTSKCTSBCTSS
SCHEMBL8098620 0.91 CTSL (0.55) CTSLCTSKCTSBCTSS
SCHEMBL8972275 0.90 CTSK (0.60) CTSLCTSKCTSBCAPN1CTSS
SCHEMBL16847835 0.88 CTSK (0.69) CTSLCTSKCTSBCAPN1CTSS
SCHEMBL8823948 0.88 CTSK (0.65) CTSLCTSKCTSBCAPN1CTSS
SCHEMBL7796791 0.84 CTSL (0.67) CTSLCTSKCTSBCAPN1CTSS
SCHEMBL7764593 0.84 CTSL (0.65) CTSLCTSKCTSBCAPN1CTSS
SCHEMBL7330463 0.82 CTSL (0.67) CTSLCTSKCTSBCAPN1CTSS
SCHEMBL7268416 0.82 CAPN1 (0.58) CTSLCTSKCTSBCAPN1CTSS

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
EP-1516877-A1 Amine derivatives as protease inhibitors AXYS PHARMACEUTICALS, INC. (US) 2005-03-23 EP disclosed
US-20030232864-A1 Novel Compounds and compositions as protease inhibitors AXYS PHARMACEUTICALS, INC. (US) 2003-12-18 US disclosed
US-6576630-B1 Alkanoyl substituted benzooxazoles or naphthooxazoles AXYS PHARMACEUTICALS, INC. 2003-06-10 US disclosed
US-20030092634-A1 Novel compounds and compositions as protease inhibitors AXYS PHARMACEUTICALS, INC. 2003-05-15 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-20030092634-A1 Novel compounds and compositions as protease inhibitors SERPINB1, HPN, CTRL CTSL 14/4885CTSK 29/4885CTSB 11/4885
US-20030232864-A1 Novel Compounds and compositions as protease inhibitors SERPINB1, CTRL, CTSZ CTSL 18/4885CTSK 32/4885CTSB 11/4885

“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.