SCHEMBL3458740

SCHEMBL3458740

[NH]c1cccc(CN(Cc2ccc(-c3ccccc3)nn2)S(=O)(=O)c2cccnc2)n1

nearest known ligand 0.53

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PTGER2 P43116 20/20 0.53

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
SCHEMBL3458743 0.89 PTGER2 (0.52) PTGER2
SCHEMBL533793 0.85 PTGER2 (0.75) PTGER2
Hydrochloric Acid SCHEMBL533659 0.85 PTGER2 (0.75) PTGER2
SCHEMBL3459562 0.78 PTGER2 (0.53) PTGER2
SCHEMBL533427 0.76 PTGER2 (0.47) PTGER2
SCHEMBL3459978 0.76 PTGER2 (0.73) PTGER2
SCHEMBL3458739 0.75 SLC1A3 (0.37) PTGER2
SCHEMBL533379 0.71 MAPT (0.51)
SCHEMBL3458631 0.70 PTGER2 (0.41) PTGER2
Hydrochloric Acid SCHEMBL534379 0.69 PTGER2 (1.00) 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-2264009-A1 PYRIDYLAMINOACETIC ACID COMPOUND Ube Industries, Ltd. (JP) 2010-12-22 EP disclosed