Glucametacin

Glucametacin

SCHEMBL9988209

CC(C)Cc1ccc(CC(=O)O)cc1.COc1ccc2c(c1)c(CC(=O)N[C@@H](C=O)[C@@H](O)[C@H](O)[C@H](O)CO)c(C)n2C(=O)c1ccc(Cl)cc1

nearest known ligand 0.63

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

PTGS1PTGS2

The experimentally established mechanism targets of Glucametacin. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PTGS2 known ✓ P35354 20/20 0.63

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
Glucametacin SCHEMBL24511 0.91 PTGS2 (0.72) PTGS2
Glucametacin SCHEMBL27641193 0.91 PTGS2 (0.72) PTGS2
Glucametacin SCHEMBL5081097 0.91 PTGS2 (0.72) PTGS2
Glucametacin SCHEMBL30344903 0.91 PTGS2 (0.72) PTGS2
Indomethacin SCHEMBL8702320 0.85 PTGS2 (0.80) PTGS2
Indomethacin SCHEMBL8509782 0.83 PTGS2 (0.74) PTGS2
SCHEMBL5080287 0.81 PLA2G2A (0.65) PTGS2
SCHEMBL5080284 0.81 PLA2G2A (0.65) PTGS2
Indomethacin SCHEMBL10489921 0.80 PTGS2 (0.86) PTGS2
Indomethacin SCHEMBL9242800 0.80 PTGS2 (0.74) PTGS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2397140-A1 Compositions and methods for treating or preventing glaucoma or progression thereof BAUSCH & LOMB INCORPORATED (US) 2011-12-21 EP disclosed