SCHEMBL7049751

SCHEMBL7049751

CC(C)(C)OC(=O)N(CCCc1ccccc1)C(=O)N[C@@H](CCc1ccccc1)C(=O)c1nc2ccccc2o1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FAAH O00519 1/20 0.46
CES1 P23141 1/20 0.46
DAGLA Q9Y4D2 1/20 0.46
PRSS8 Q16651 2/20 0.46
CTSS P25774 10/20 0.43
CTSK P43235 3/20 0.43
CTSL P07711 2/20 0.43
CTSB P07858 2/20 0.43
XDH P47989 2/20 0.40
PPARG P37231 2/20 0.40
PPARD Q03181 1/20 0.39
PPARA Q07869 1/20 0.39
CMA1 P23946 2/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2C9 P11712 1/20 0.38

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
SCHEMBL7049337 0.88 PRSS8 (0.45) FAAHCES1DAGLAPRSS8CTSS
SCHEMBL7046962 0.83 PRSS8 (0.49) FAAHCES1DAGLAPRSS8CTSS
SCHEMBL6475526 0.82 FAAH (0.46) FAAHCES1DAGLAPRSS8CTSS
SCHEMBL7049749 0.82 DAGLA (0.50) FAAHCES1DAGLAXDHPPARG
SCHEMBL7043196 0.80 PRSS8 (0.36) DAGLAPRSS8CTSSCTSKCTSL
SCHEMBL6467558 0.80 FAAH (0.46) FAAHCES1DAGLAPRSS8CTSS
SCHEMBL7045498 0.79 PRSS8 (0.49) FAAHCES1DAGLAPRSS8CTSS
SCHEMBL7046460 0.77 PRSS8 (0.47) FAAHCES1DAGLAPRSS8CTSS
SCHEMBL6061657 0.77 PRSS8 (0.43) PRSS8CTSSCTSKCTSLCTSB
SCHEMBL6464410 0.77 FAAH (0.42) FAAHCES1DAGLAPRSS8CTSS

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 FAAH 479/4885CES1 272/4885DAGLA 2304/4885

“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.