SCHEMBL7049595

SCHEMBL7049595

CC(CCNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1)CC(=O)NCC(O)(CCc1ccccc1)c1nc2cc(S(N)(=O)=O)ccc2o1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTSL P07711 1/20 0.42
CTSB P07858 1/20 0.42
CTSS P25774 1/20 0.42
CTSK P43235 1/20 0.42
STS P08842 1/20 0.39
ALDH1A1 P00352 2/20 0.38
LMNA P02545 2/20 0.37
MAPT P10636 1/20 0.37
HTT P42858 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
GPR119 Q8TDV5 1/20 0.36
NOD2 Q9HC29 1/20 0.36
NOD1 Q9Y239 1/20 0.36
MEN1 O00255 3/20 0.36
KMT2A Q03164 3/20 0.36
CA12 O43570 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA9 Q16790 1/20 0.36
EPHX2 P34913 1/20 0.35

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
SCHEMBL7046425 0.90 LMNA (0.39) CTSLCTSBCTSSCTSKSTS
SCHEMBL6063357 0.90 CTSL (0.42) CTSLCTSBCTSSCTSKSTS
SCHEMBL7046971 0.85 GPR119 (0.39) STSALDH1A1LMNAMAPTHTT
SCHEMBL7044980 0.85 GPR119 (0.39) STSALDH1A1LMNAMAPTHTT
SCHEMBL7047993 0.82 CTSS (0.44) CTSLCTSBCTSSCTSKSTS
SCHEMBL7046158 0.72 LMNA (0.40) CTSLCTSBCTSSCTSKSTS
SCHEMBL7049421 0.72 CTSL (0.44) CTSLCTSBCTSSCTSKSTS
SCHEMBL7045283 0.70 CTSS (0.57) CTSLCTSBCTSSCTSKALDH1A1
SCHEMBL7047991 0.69 CTSL (0.47) CTSLCTSBCTSSCTSKSTS
SCHEMBL7049593 0.69 CTSL (0.44) CTSLCTSBCTSSCTSKSTS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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

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-20030232864-A1 Novel Compounds and compositions as protease inhibitors SERPINB1, CTRL, CTSZ CTSL 18/4885CTSB 11/4885CTSS 9/4885

“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.