SCHEMBL5121659

SCHEMBL5121659

COC(=O)c1cccc(CSc2nc3cc(C(F)(F)F)ccc3n2CC(=O)O)c1

nearest known ligand 0.75

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 18/20 0.75
DRD2 P14416 1/20 0.56
TBXA2R P21731 1/20 0.56
MAPT P10636 1/20 0.49

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
SCHEMBL5113433 0.88 PTGDR2 (0.79) PTGDR2DRD2TBXA2R
SCHEMBL5109253 0.86 PTGDR2 (1.00) PTGDR2DRD2TBXA2RMAPT
SCHEMBL5121445 0.84 PTGDR2 (0.65) PTGDR2DRD2TBXA2R
SCHEMBL5110218 0.84 PTGDR2 (0.79) PTGDR2DRD2TBXA2RMAPT
SCHEMBL5115652 0.84 PTGDR2 (0.75) PTGDR2DRD2TBXA2RMAPT
SCHEMBL5115872 0.83 PTGDR2 (0.77) PTGDR2DRD2TBXA2RMAPT
SCHEMBL5116325 0.83 PTGDR2 (0.74) PTGDR2DRD2TBXA2RMAPT
SCHEMBL5113091 0.83 PTGDR2 (0.51) PTGDR2DRD2TBXA2RMAPT
SCHEMBL5500425 0.77 PTGDR2 (0.65) PTGDR2
SCHEMBL5107110 0.76 PTGDR2 (1.00) PTGDR2

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
US-20080108638-A1 2-Sulfanyl-Benzoimidazol-1-Yl-Acetic Acid Derivatives as Crth2 Antagonists ACTELION PHARMACEUTICALS,LTD. (CH) 2008-05-08 US claimed
US-8273740-B2 antiallergen; not direct way to change nature of immunological response to allergen; G-protein-coupled \"chemoattractant receptor-homologous molecule expressed on Th2 cells (CRTH2)\" antagonist for prostaglandin PGD2, that mediates PGD2-dependent migration of blood Th2 cells; ; asthma, rhinitis, COPD ACTELION PHARMACEUTICALS, LTD. (CH) 2012-09-25 US disclosed
US-20080108638-A1 2-Sulfanyl-Benzoimidazol-1-Yl-Acetic Acid Derivatives as Crth2 Antagonists ACTELION PHARMACEUTICALS,LTD. (CH) 2008-05-08 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-20080108638-A1 2-Sulfanyl-Benzoimidazol-1-Yl-Acetic Acid Derivatives as Crth2 Antagonists HRH2, HRH1, HRH3 PTGDR2 12/4885DRD2 1984/4885TBXA2R 20/4885

“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.