SCHEMBL4431792

SCHEMBL4431792

CSC(=N)NS(=O)(=O)c1c(C)c(C)c2c(c1C)CCC(C)(C)O2

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PLG P00747 3/20 0.41
PLAU P00749 2/20 0.41
F10 P00742 1/20 0.41
KLKB1 P03952 1/20 0.41
PTGS1 P23219 1/20 0.35
PTGS2 P35354 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
TSHR P16473 1/20 0.35
F2 P00734 2/20 0.35
CCR5 P51681 1/20 0.30
HSP90AA1 P07900 1/20 0.30
HSP90AB1 P08238 1/20 0.30
ST14 Q9Y5Y6 1/20 0.30

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
SCHEMBL18620596 0.85 PLG (0.41) PLGPLAUF10KLKB1PTGS1
SCHEMBL18506897 0.81 PLG (0.41) PLGPLAUF10KLKB1PTGS1
SCHEMBL18545144 0.80 PLG (0.41) PLGPLAUF10KLKB1PTGS1
SCHEMBL8529805 0.79 PLG (0.39) PLGPLAUF10KLKB1PTGS1
SCHEMBL4082092 0.79 PLG (0.41) PLGPLAUF10KLKB1PTGS1
SCHEMBL4530181 0.77 PTGS1 (0.42) PLGPLAUF10KLKB1PTGS1
SCHEMBL8531015 0.77 CYP1A2 (0.39) PLGPLAUF10KLKB1PTGS1
SCHEMBL8294965 0.76 CYP1A2 (0.43) PLGPLAUF10KLKB1PTGS1
SCHEMBL6455667 0.76 PLG (0.41) PLGPLAUF10KLKB1PTGS1
SCHEMBL850468 0.75 PLG (0.45) PLGPLAUF10KLKB1CYP3A4

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 PLG 52/4885PLAU 156/4885F10 432/4885

“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.