SCHEMBL481242

SCHEMBL481242

CCCc1c(S(=O)(=O)Cc2ccc(C(OC3CCCCO3)c3cccc(C#N)c3)cc2)ccc(C(C)=O)c1O

nearest known ligand 0.33

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CCR5 P51681 1/20 0.32
PTGER4 P35408 1/20 0.32
GRM2 Q14416 2/20 0.31
MGLL Q99685 1/20 0.31
CYSLTR1 Q9Y271 5/20 0.31
CYSLTR2 Q9NS75 3/20 0.31
CNR2 P34972 1/20 0.31
TBXAS1 P24557 1/20 0.30
LTB4R Q15722 1/20 0.30
LTB4R2 Q9NPC1 1/20 0.30
KCNK3 O14649 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
SCHEMBL481296 0.87 CYSLTR1 (0.42) GRM2CYSLTR1CYSLTR2TBXAS1LTB4R
SCHEMBL480876 0.86 PPARG (0.34) PTGER4GRM2MGLLCYSLTR1CYSLTR2
SCHEMBL480875 0.86 PPARG (0.34) PTGER4GRM2MGLLCYSLTR1CYSLTR2
SCHEMBL480877 0.86 PPARG (0.34) PTGER4GRM2MGLLCYSLTR1CYSLTR2
SCHEMBL481249 0.86 PTGER4 (0.33) PTGER4GRM2MGLLCYSLTR1CYSLTR2
SCHEMBL481120 0.84 CYSLTR1 (0.45) GRM2CYSLTR1CYSLTR2TBXAS1LTB4R
SCHEMBL481036 0.82 CYSLTR1 (0.35) PTGER4GRM2CYSLTR1CYSLTR2
SCHEMBL481200 0.79 MAPT (0.44) GRM2CYSLTR1
SCHEMBL481229 0.79 CYSLTR1 (0.44) GRM2CYSLTR1CYSLTR2TBXAS1LTB4R
SCHEMBL481104 0.79 PTGER4 (0.34) PTGER4MGLLKCNK3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2441762-A1 Potentiators of Glutamate Receptors Eli Lilly and Company (US) 2012-04-18 EP disclosed
EP-1817301-B1 POTENTIATORS OF GLUTAMATE RECEPTORS LILLY CO ELI (US) 2012-02-01 EP disclosed
US-7816523-B2 Potentiators of glutamate receptors ELI LILLY AND COMPANY (US) 2010-10-19 US disclosed
US-7803938-B2 Potentiators of glutamate receptors ELI LILLY AND COMPANY (US) 2010-09-28 US disclosed
US-20090318481-A1 Potentiators Of Glutamate Receptors AICHER THOMAS DANIEL 2009-12-24 US disclosed
US-20090318483-A1 Potentiators Of Glutamate Receptors AICHER THOMAS DANIEL 2009-12-24 US disclosed
US-7598423-B2 Potentiators of glutamate receptors ELI LILLY AND COMPANY (US) 2009-10-06 US disclosed
US-20080139505-A1 Potentiators Of Glutamate Receptors ARRAY BIOPHARMA, INC. 2008-06-12 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 (3 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-20080139505-A1 Potentiators Of Glutamate Receptors GRM1, GRIN1, GRM2 CCR5 1507/4885PTGER4 572/4885GRM2 3/4885
US-20090318481-A1 Potentiators Of Glutamate Receptors GRIK1, GRIK2, GRIK4 CCR5 1277/4885PTGER4 418/4885GRM2 8/4885
US-20090318483-A1 Potentiators Of Glutamate Receptors GRIK1, GRIK2, GRIK4 CCR5 1277/4885PTGER4 418/4885GRM2 8/4885

“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.