SCHEMBL534497

SCHEMBL534497

CC(C)(C)OC(=O)N(c1cccc(C(Cc2ccc(-c3ncc(Cl)s3)cc2)NS(=O)(=O)c2ccccn2)n1)C(C(=O)O)C(C)(C)C

nearest known ligand 0.37

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PTPRB P23467 3/20 0.37
MMP2 P08253 2/20 0.32
MMP9 P14780 2/20 0.32
MMP13 P45452 1/20 0.31
PTGER2 P43116 4/20 0.30
PAX8 Q06710 1/20 0.30

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
SCHEMBL533628 0.93 PTPRB (0.37) PTPRBMMP2MMP9MMP13PTGER2
SCHEMBL533315 0.90 PTPRB (0.38) PTPRBPTGER2
SCHEMBL535157 0.89 PTPRB (0.36) PTPRBMMP13PTGER2PAX8
SCHEMBL533587 0.88 PTPRB (0.36) PTPRBMMP2MMP9PTGER2PAX8
SCHEMBL10320468 0.87 PTPRB (0.38) PTPRBMMP13PTGER2
SCHEMBL534466 0.87 PTPRB (0.34) PTPRBMMP2MMP9MMP13PTGER2
SCHEMBL533502 0.84 PTGER2 (0.33) PTPRBMMP13PTGER2
SCHEMBL10323124 0.83 PPARG (0.35) PTPRBMMP13PTGER2
SCHEMBL534495 0.83 PTPRB (0.30) PTPRB
SCHEMBL534496 0.82 PTGER2 (0.48) PTGER2

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-8648097-B2 Pyridylaminoacetic acid compound UBE INDUSTRIES, LTD. (JP) 2014-02-11 US disclosed
US-20120190852-A1 MEDICAL COMPOSITION FOR TREATMENT OR PROPHYLAXIS OF GLAUCOMA UBE INDUSTRIES, LTD. (JP) 2012-07-26 US disclosed
EP-2415763-A1 PHARMACEUTICAL COMPOSITION FOR TREATING OR PREVENTING GLAUCOMA Ube Industries, Ltd. (JP) 2012-02-08 EP disclosed
EP-2264009-A1 PYRIDYLAMINOACETIC ACID COMPOUND Ube Industries, Ltd. (JP) 2010-12-22 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-20120190852-A1 MEDICAL COMPOSITION FOR TREATMENT OR PROPHYLAXIS OF GLAUCOMA F12, C1S, AKR1C3 PTPRB 4696/4885MMP2 1315/4885MMP9 2183/4885

“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.