SCHEMBL9819938

SCHEMBL9819938

O=Nc1cc(Br)c(O)cc1O

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ ALOX15 P16050 2/20 0.36
▸ HSP90AA1 P07900 1/20 0.33
▸ CISD1 Q9NZ45 1/20 0.32
▸ KDM4E B2RXH2 1/20 0.31
▸ ALOX12 P18054 1/20 0.31
▸ BACE1 P56817 1/20 0.30
▸ AMY1A P0DUB6 1/20 0.30
▸ GPR35 Q9HC97 1/20 0.30

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
SCHEMBL18799257 0.86 ALOX15 (0.36) ALOX15CISD1BACE1AMY1AGPR35
SCHEMBL24817709 0.80 IDO1 (0.30) —
SCHEMBL12722836 0.76 GSK3B (0.35) ALOX15KDM4EALOX12
SCHEMBL69493 0.73 ALOX15 (0.50) ALOX15HSP90AA1ALOX12
SCHEMBL1005024 0.71 TSHR (0.46) HSP90AA1
SCHEMBL9820018 0.71 MAPT (0.42) ALOX15KDM4EALOX12
SCHEMBL1001806 0.71 CA3 (0.36) KDM4E
SCHEMBL13636128 0.70 SRC (0.37) ALOX15KDM4E
SCHEMBL25704899 0.70 KDM4E (0.34) KDM4E
SCHEMBL28644250 0.70 ALOX15 (0.44) ALOX15KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0210559-B1 N-ACYLDIHYDRORESORUFIN DERIVATIVES, PROCESS FOR THEIR PREPARATION AS WELL AS THEIR USE FOR THE DETERMINATION OF HYDROGEN PEROXIDE, PEROXIDATICALLY ACTIVE COMPOUNDS, OR PEROXIDASE Roche Diagnostics GmbH (DE) 1991-09-25 — — EP disclosed
EP-0156347-B1 GLYCOSIDES OF RESOFURIN DERIVATIVES, METHOD FOR THEIR PREPARATION AND THEIR USE IN THE DETERMINATION OF THE ACTIVITY OF GLYCOSIDASES Roche Diagnostics GmbH (DE) 1991-09-04 — — EP disclosed
US-4737466-A N-acyldihydroresorufin derivatives, processes for their preparation, reagents containing them and the use thereof for determining hydrogen peroxide, peroxidate-acting compounds or peroxidase BOEHRINGER MANNHEIM GMBH (DE) 1988-04-12 — — US disclosed
EP-0156347-A2 Glycosides of resofurin derivatives, method for their preparation and their use in the determination of the activity of glycosidases Roche Diagnostics GmbH (DE) 1985-10-02 — — EP disclosed
Send feedback