SCHEMBL7043318

SCHEMBL7043318

CC(C)CCN(CS(=O)(=O)NCC(O)(CCc1ccccc1)c1nc2ccccc2o1)C(=O)OCc1ccccc1

nearest known ligand 0.34

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PPARG P37231 4/20 0.34
ELANE P08246 2/20 0.32
FAAH O00519 1/20 0.32
CES1 P23141 1/20 0.32
DAGLA Q9Y4D2 1/20 0.32
XDH P47989 1/20 0.31
PPARD Q03181 3/20 0.31
PPARA Q07869 3/20 0.31
CCR6 P51684 1/20 0.31
PAX8 Q06710 1/20 0.31
ATM Q13315 1/20 0.31
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31

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
SCHEMBL6466231 0.91 FAAH (0.35) PPARGFAAHCES1DAGLAXDH
SCHEMBL7044878 0.78 ELANE (0.41) ELANEFAAHCES1DAGLAXDH
SCHEMBL6062665 0.74 MTNR1A (0.35) FAAHCES1DAGLAXDH
SCHEMBL7049043 0.72 MAPT (0.38) ATM
SCHEMBL7044871 0.71 FAAH (0.40) PPARGELANEFAAHCES1DAGLA
SCHEMBL7049306 0.68 DAGLA (0.44) FAAHCES1DAGLAXDHNPC1
SCHEMBL7046959 0.67 DAGLA (0.45) PPARGELANEFAAHCES1DAGLA
SCHEMBL6466202 0.67 LMNA (0.36) FAAHCES1DAGLAXDHNPC1
SCHEMBL6467037 0.67 FAAH (0.36) FAAHCES1DAGLAXDHNPC1
SCHEMBL6462741 0.67 FAAH (0.36) FAAHCES1DAGLAXDH

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 PPARG 4143/4885ELANE 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.