SCHEMBL534189

SCHEMBL534189

CC(C)(C)OC(=O)N(CC(=O)O)c1cccc(C(N)(Cc2ccc(-c3nccs3)cc2)S(=O)(=O)c2ccccn2)n1

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALOX5AP P20292 2/20 0.35
F2 P00734 2/20 0.34
GPR119 Q8TDV5 1/20 0.34
SLC6A9 P48067 1/20 0.33
PTGER2 P43116 9/20 0.33
KAT6A Q92794 1/20 0.32
PTGDR2 Q9Y5Y4 1/20 0.32
CYP3A4 P08684 1/20 0.31
CYP2D6 P10635 1/20 0.31
CYP2C9 P11712 1/20 0.31
FFAR1 O14842 1/20 0.31

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
SCHEMBL533415 0.91 PTGER2 (0.34) F2PTGER2
SCHEMBL13571621 0.90 PTGER2 (0.35) F2PTGER2
SCHEMBL17472671 0.89 PTGER2 (0.34) F2PTGER2
SCHEMBL12981021 0.89 PTGER2 (0.43) F2PTGER2
SCHEMBL534182 0.89 PPARA (0.33) F2PTGER2
SCHEMBL533324 0.88 ALOX5AP (0.33) ALOX5APF2PTGER2
SCHEMBL533480 0.88 PTGER2 (0.32) F2PTGER2FFAR1
SCHEMBL17472592 0.88 PTGER2 (0.40) F2PTGER2
SCHEMBL533776 0.88 PTGER2 (0.37) F2GPR119PTGER2
SCHEMBL533841 0.88 GPR119 (0.34) ALOX5APF2GPR119SLC6A9PTGER2

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 6 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-2476678-A1 SUBSTITUTED CARBONYL COMPOUNDS Ube Industries, Ltd. (JP) 2012-07-18 EP 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
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 (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 ALOX5AP 92/4885F2 406/4885GPR119 615/4885
US-20110054172-A1 PYRIDYLAMINOACETIC ACID COMPOUND PTGER2, PTGER1, PTGDR2 ALOX5AP 92/4885F2 576/4885GPR119 412/4885

“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.