SCHEMBL535045

SCHEMBL535045

CC(C)(C)OC(=O)N(CC(=O)O)c1cccc(C(Cc2ccc(-c3ccccc3)cc2)NS(=O)(=O)c2ccccn2)n1

nearest known ligand 0.40

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PTGER2 P43116 13/20 0.40
PTPRB P23467 3/20 0.37
BCL2 P10415 1/20 0.36
ITGB3 P05106 1/20 0.35
ITGAV P06756 1/20 0.35
CTSK P43235 1/20 0.34

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
SCHEMBL17472596 0.95 PTGER2 (0.46) PTGER2PTPRBBCL2ITGB3ITGAV
SCHEMBL17472660 0.94 PTGER2 (0.46) PTGER2PTPRBBCL2ITGB3ITGAV
SCHEMBL17472598 0.94 PTGER2 (0.41) PTGER2PTPRBBCL2
SCHEMBL17472733 0.94 PTGER2 (0.48) PTGER2PTPRBBCL2ITGB3ITGAV
SCHEMBL17472675 0.93 PTGER2 (0.36) PTGER2PTPRB
SCHEMBL12981024 0.93 PTGER2 (0.44) PTGER2PTPRB
SCHEMBL13571659 0.93 PTGER2 (0.36) PTGER2PTPRB
SCHEMBL533682 0.93 PTGER2 (0.36) PTGER2PTPRBCTSK
SCHEMBL17472679 0.93 PTGER2 (0.48) PTGER2
SCHEMBL10316589 0.92 PTPRB (0.36) PTGER2PTPRBITGB3ITGAV

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-2415763-B1 PHARMACEUTICAL COMPOSITION FOR TREATING OR PREVENTING GLAUCOMA UBE INDUSTRIES (JP) 2016-01-27 EP disclosed
US-20140113907-A1 PYRIDYLAMINOACETIC ACID COMPOUND UBE INDUSTRIES, LTD. (JP) 2014-04-24 US disclosed
EP-2415763-A1 PHARMACEUTICAL COMPOSITION FOR TREATING OR PREVENTING GLAUCOMA Ube Industries, Ltd. (JP) 2012-02-08 EP disclosed
US-20110054172-A1 PYRIDYLAMINOACETIC ACID COMPOUND UBE CORPORATION (JP) 2011-03-03 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 (2 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-20140113907-A1 PYRIDYLAMINOACETIC ACID COMPOUND PTGER2, PTGER1, PTGDR2 PTGER2 1/4885PTPRB 2129/4885BCL2 3786/4885
US-20110054172-A1 PYRIDYLAMINOACETIC ACID COMPOUND PTGER2, PTGER1, PTGDR2 PTGER2 1/4885PTPRB 2141/4885BCL2 3982/4885

“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.