SCHEMBL7046274

SCHEMBL7046274

CC(C)CCN(C(=O)OCc1ccccc1)C(=O)N(C)C(=O)c1nc2ccccc2o1

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
XDH P47989 4/20 0.41
ELANE P08246 3/20 0.40
FAAH O00519 1/20 0.40
CES1 P23141 1/20 0.40
DAGLA Q9Y4D2 1/20 0.40
PPARG P37231 2/20 0.38
HSF1 Q00613 6/20 0.38
PRSS8 Q16651 1/20 0.37
KDM4E B2RXH2 1/20 0.36
RAB9A P51151 1/20 0.36
GLO1 Q04760 1/20 0.36

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
SCHEMBL7043306 0.89 AAK1 (0.38) XDHELANEFAAHDAGLARAB9A
SCHEMBL7046959 0.88 DAGLA (0.45) XDHELANEFAAHCES1DAGLA
SCHEMBL6461916 0.85 HSF1 (0.42) XDHFAAHCES1DAGLAPPARG
SCHEMBL7045497 0.81 DAGLA (0.46) XDHELANEFAAHCES1DAGLA
SCHEMBL7046962 0.81 PRSS8 (0.49) XDHELANEFAAHCES1DAGLA
SCHEMBL7049760 0.79 DAGLA (0.54) XDHFAAHCES1DAGLAPPARG
SCHEMBL7049748 0.78 XDH (0.40) XDHELANEFAAHCES1DAGLA
SCHEMBL6183141 0.78 ALOX5 (0.43)
SCHEMBL7045498 0.77 PRSS8 (0.49) XDHELANEFAAHCES1DAGLA
SCHEMBL7046458 0.77 DAGLA (0.44) XDHFAAHCES1DAGLAPPARG

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 XDH 705/4885ELANE 50/4885FAAH 479/4885

“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.