SCHEMBL2670035

SCHEMBL2670035

CCOC(=O)Cn1c(C)c(Cc2ccccc2S(=O)(=O)N2CCCCC2)c2cc(F)ccc21

nearest known ligand 0.60

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 19/20 0.60
ALDH1A1 P00352 1/20 0.42
HK1 P19367 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
HKDC1 Q2TB90 1/20 0.42
PTGIR P43119 1/20 0.42
PTGDR Q13258 1/20 0.42

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
SCHEMBL1782810 0.90 PTGDR2 (0.75) PTGDR2PTGIRPTGDR
SCHEMBL1784363 0.89 PTGDR2 (0.76) PTGDR2PTGIRPTGDR
SCHEMBL2670026 0.87 PTGDR2 (0.65) PTGDR2ALDH1A1HK1SMN1; SMN2HKDC1
SCHEMBL2277554 0.86 PTGDR2 (0.75) PTGDR2ALDH1A1HK1SMN1; SMN2HKDC1
SCHEMBL2272115 0.86 PTGDR2 (0.81) PTGDR2
SCHEMBL2670014 0.86 PTGDR2 (0.64) PTGDR2ALDH1A1HK1SMN1; SMN2HKDC1
SCHEMBL2670222 0.86 PTGDR2 (0.57) PTGDR2ALDH1A1HK1SMN1; SMN2HKDC1
SCHEMBL2670024 0.85 PTGDR2 (0.62) PTGDR2ALDH1A1HK1SMN1; SMN2HKDC1
SCHEMBL3178268 0.84 PTGDR2 (0.62) PTGDR2SMN1; SMN2
SCHEMBL2670051 0.84 PTGDR2 (0.49) PTGDR2PTGDR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8168673-B2 Compounds having CRTH2 antagonist activity OXAGEN LIMITED (GB) 2012-05-01 US disclosed
EP-2240444-A1 COMPOUNDS HAVING CRTH2 ANTAGONIST ACTIVITY Oxagen Limited (GB) 2010-10-20 EP disclosed
US-20090192195-A1 Compounds Having CRTH2 Antagonist Activity OXAGEN LIMITED (GB) 2009-07-30 US disclosed
WO-2009093029-A1 COMPOUNDS HAVING CRTH2 ANTAGONIST ACTIVITY OXAGEN LIMITED (GB) 2009-07-30 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-20090192195-A1 Compounds Having CRTH2 Antagonist Activity HRH2, NR3C2, NR2C2 PTGDR2 112/4885ALDH1A1 3417/4885HK1 2392/4885

“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.