SCHEMBL12981150

SCHEMBL12981150

CCC(CC)c1ccc(CN(Cc2cccc(NCC(=O)O)n2)S(=O)(=O)c2cccnc2)cc1

nearest known ligand 0.76

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PTGER2 P43116 20/20 0.76
PTGER4 P35408 1/20 0.68

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
SCHEMBL18725086 0.88 PTGER2 (0.89) PTGER2PTGER4
SCHEMBL10316712 0.87 PTGER2 (0.72) PTGER2PTGER4
SCHEMBL10316859 0.86 PTGER2 (0.80) PTGER2PTGER4
SCHEMBL10316814 0.86 PTGER2 (0.83) PTGER2PTGER4
Hydrochloric Acid SCHEMBL534379 0.86 PTGER2 (1.00) PTGER2PTGER4
SCHEMBL533125 0.86 PTGER2 (1.00) PTGER2PTGER4
SCHEMBL12982328 0.86 PTGER2 (1.00) PTGER2
Hydrochloric Acid SCHEMBL12981114 0.86 PTGER2 (1.00) PTGER2
SCHEMBL10322376 0.85 PTGER2 (0.75) PTGER2PTGER4
Hydrochloric Acid SCHEMBL10316624 0.85 PTGER2 (0.75) PTGER2PTGER4

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
EP-2520570-A1 AMINOPYRIDINE COMPOUND Ube Industries, Ltd. (JP) 2012-11-07 EP claimed
US-20120259123-A1 AMINOPYRIDINE COMPOUND UBE INDUSTRIES, LTD. (JP) 2012-10-11 US claimed
EP-2520570-A1 AMINOPYRIDINE COMPOUND Ube Industries, Ltd. (JP) 2012-11-07 EP disclosed
US-20120259123-A1 AMINOPYRIDINE COMPOUND UBE INDUSTRIES, LTD. (JP) 2012-10-11 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-20120259123-A1 AMINOPYRIDINE COMPOUND PTGIS, QDPR, PTGIR PTGER2 59/4885PTGER4 186/4885

“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.