SCHEMBL17938043

SCHEMBL17938043

CC(C)n1cc([N+](=O)[O-])c2cc(-n3cc(OC(=O)O)cn3)ccc21

nearest known ligand 0.73

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
HSP90AA1 P07900 1/20 0.36

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
SCHEMBL1647158 0.85 HPGDS (0.43)
SCHEMBL17938038 0.81
SCHEMBL1647809 0.80 MAPT (0.41)
SCHEMBL17938046 0.74 XDH (0.41)
SCHEMBL17938045 0.69 PFKFB2 (0.46)
SCHEMBL3716982 0.67 THRA (0.43)
SCHEMBL27176723 0.65 HPGDS (0.45)
SCHEMBL17938047 0.65 XDH (0.46)
SCHEMBL1647683 0.65 KMO (0.44)
SCHEMBL17938044 0.65 XDH (0.47)

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-2467378-B1 COMPOUNDS EFFECTIVE AS XANTHINE OXIDASE INHIBITORS, METHOD FOR PREPARING THE SAME, AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME LG LIFE SCIENCES LTD (KR) 2016-07-27 EP claimed