SCHEMBL4439638

SCHEMBL4439638

CC(C)(C)OC(=O)NC(=N)NC(=O)CC[C@H](NC(=O)c1ccc(C(c2ccccc2)c2ccccc2)s1)C(=O)O

nearest known ligand 0.52

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
C3AR1 Q16581 16/20 0.52
PPARG P37231 3/20 0.39
PPARA Q07869 3/20 0.39
ACE P12821 1/20 0.38
PPARD Q03181 2/20 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
SCHEMBL4429809 0.85 C3AR1 (0.47) C3AR1PPARGPPARAACEPPARD
SCHEMBL4991996 0.83 C3AR1 (0.64) C3AR1
SCHEMBL4428307 0.81 C3AR1 (0.61) C3AR1
SCHEMBL27793047 0.81 C3AR1 (0.63) C3AR1
SCHEMBL27793048 0.81 C3AR1 (0.63) C3AR1
SCHEMBL4438829 0.79 C3AR1 (0.52) C3AR1
SCHEMBL14090969 0.79 NPSR1 (0.42) C3AR1PPARGPPARAPPARD
SCHEMBL4432520 0.78 C3AR1 (0.69) C3AR1
SCHEMBL27772085 0.76 C3AR1 (0.69) C3AR1
SCHEMBL27792997 0.76 C3AR1 (0.48) C3AR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2125739-A1 MODULATORS OF C3A RECEPTOR AND METHODS OF USE THEREOF ENCYSIVE PHARMACEUTICALS, INC. (US) 2009-12-02 EP disclosed
US-20080188528-A1 Modulators of C3a receptor and methods of use thereof ENCYSIVE PHARMACEUTICALS, INC. 2008-08-07 US disclosed
WO-2008079371-A1 MODULATORS OF C3A RECEPTOR AND METHODS OF USE THEREOF ENCYSIVE PHARMACEUTICALS, INC. (US) 2008-07-03 WO 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-20080188528-A1 Modulators of C3a receptor and methods of use thereof C3AR1, C5, C5AR1 C3AR1 1/4885PPARG 2064/4885PPARA 1091/4885

“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.