SCHEMBL534348

SCHEMBL534348

CC(=O)ONc1cccc(CN(Cc2ccc(-c3nccs3)cc2)S(=O)(=O)c2ccc(F)cc2)n1

nearest known ligand 0.52

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PTGER2 P43116 19/20 0.52
KCNA5 P22460 1/20 0.48

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
SCHEMBL3458311 0.86 PTGER2 (0.59) PTGER2
SCHEMBL533352 0.86 PTGER2 (0.69) PTGER2
Hydrochloric Acid SCHEMBL534174 0.86 PTGER2 (0.69) PTGER2
SCHEMBL533842 0.78 PTGER2 (0.49) PTGER2KCNA5
SCHEMBL11023383 0.75 PTGER2 (0.47) PTGER2KCNA5
Hydrochloric Acid SCHEMBL533589 0.73 PTGER2 (0.79) PTGER2
SCHEMBL533151 0.73 PTGER2 (0.79) PTGER2
Trifluoroacetic Acid SCHEMBL3458594 0.71 PTGER2 (0.72) PTGER2
SCHEMBL533204 0.71 PTGER2 (0.81) PTGER2
Hydrochloric Acid SCHEMBL10316789 0.71 PTGER2 (0.81) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2415763-A1 PHARMACEUTICAL COMPOSITION FOR TREATING OR PREVENTING GLAUCOMA Ube Industries, Ltd. (JP) 2012-02-08 EP disclosed