SCHEMBL6101974

SCHEMBL6101974

CN1C[C@@H](COc2ccc(C(=O)Cl)cn2)Oc2ccccc21

nearest known ligand 0.48

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PTGIR P43119 15/20 0.48
PTGDR Q13258 2/20 0.45
TBXA2R P21731 1/20 0.45

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
SCHEMBL6100655 0.90 PTGIR (0.51) PTGIRPTGDRTBXA2R
SCHEMBL6101497 0.89 PTGIR (0.50) PTGIR
SCHEMBL2190959 0.84 PTGIR (0.60) PTGIRPTGDRTBXA2R
SCHEMBL6102794 0.77 PTGIR (0.79) PTGIRPTGDRTBXA2R
SCHEMBL730460 0.77 PTGIR (0.64) PTGIRPTGDR
SCHEMBL2191851 0.77 PTGIR (0.64) PTGIRPTGDR
SCHEMBL2189965 0.77 PTGIR (0.64) PTGIRPTGDRTBXA2R
SCHEMBL731003 0.76 PTGDR (0.62) PTGIRPTGDR
SCHEMBL2193189 0.75 PTGIR (0.62) PTGIRPTGDRTBXA2R
SCHEMBL730628 0.74 PTGIR (0.63) PTGIRPTGDR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060089353-A1 Indole derivative compounds and drugs containing the compounds as the active ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 2006-04-27 US disclosed
EP-1600440-A1 INDOLE DERIVATIVE COMPOUNDS AND DRUGS CONTAINING THE COMPOUNDS AS THE ACTIVE INGREDIENT ONO PHARMACEUTICAL CO., LTD. (JP) 2005-11-30 EP 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-20060089353-A1 Indole derivative compounds and drugs containing the compounds as the active ingredient PTGIS, IDO1, IDO2 PTGIR 4/4885PTGDR 11/4885TBXA2R 130/4885

“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.