SCHEMBL7043343

SCHEMBL7043343

CC(=O)NC(Cc1ccccc1)C(=O)N[C@@H](CCc1ccccc1)C(=O)c1nc2ccccc2o1

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CTSS P25774 9/20 0.49
CTSK P43235 3/20 0.49
CTSL P07711 2/20 0.49
CTSB P07858 2/20 0.49
GNPAT O15228 1/20 0.47
FAAH O00519 1/20 0.47
CES1 P23141 1/20 0.47
DAGLA Q9Y4D2 1/20 0.47
XDH P47989 2/20 0.45
PRSS8 Q16651 2/20 0.45
CMA1 P23946 2/20 0.44
CPA1 P15085 1/20 0.44
CPA2 P48052 1/20 0.44
CPA4 Q9UI42 1/20 0.44
CYP3A4 P08684 1/20 0.43
CYP2C9 P11712 1/20 0.43

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
SCHEMBL7046616 0.91 MMP12 (0.47) CTSSCTSKCTSLCTSBGNPAT
SCHEMBL7181300 0.91 CTSS (0.47) CTSSCTSKCTSLCTSBFAAH
SCHEMBL7049727 0.88 CTSS (0.46) CTSSCTSKCTSLCTSBFAAH
SCHEMBL6471948 0.88 CTSS (0.50) CTSSCTSKCTSLCTSBFAAH
SCHEMBL6061690 0.85 CTSS (0.49) CTSSCTSKCTSLCTSBPRSS8
SCHEMBL6462739 0.85 CTSS (0.49) CTSSCTSKCTSLCTSBPRSS8
SCHEMBL7046177 0.85 CTSS (0.49) CTSSCTSKCTSLCTSBPRSS8
SCHEMBL7043345 0.82 CTSS (0.47) CTSSCTSKCTSLCTSBGNPAT
SCHEMBL6466909 0.81 DAGLA (0.56) CTSSCTSKCTSLCTSBFAAH
SCHEMBL6466589 0.81 DAGLA (0.56) CTSSCTSKCTSLCTSBFAAH

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 CTSS 9/4885CTSK 32/4885CTSL 18/4885

“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.