SCHEMBL3401567

SCHEMBL3401567

[CH2]c1cccc(N=O)c1N=O

nearest known ligand 0.35

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
HSP90AA1 P07900 1/20 0.35

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
SCHEMBL12123913 0.82 HSP90AA1 (0.42) HSP90AA1
SCHEMBL1955164 0.77
SCHEMBL28144521 0.74 KMT2A (0.42) HSP90AA1
SCHEMBL28249824 0.74 CYP3A4 (0.32)
SCHEMBL28272053 0.71 HSP90AA1 (0.45) HSP90AA1
SCHEMBL11918053 0.71 CES2 (0.36) HSP90AA1
SCHEMBL30712636 0.71 HSP90AA1 (0.45) HSP90AA1
SCHEMBL11232182 0.71 GRIN2D (0.40) HSP90AA1
SCHEMBL6558400 0.71 GAA (0.42) HSP90AA1
SCHEMBL6050004 0.71 KMT2A (0.43) HSP90AA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2174909-A1 Composition comprising a layered double hydroxide Akzo Nobel N.V. (NL) 2010-04-14 EP disclosed
WO-2009043861-A1 COMPOSITE MATERIAL, PROCESS FOR PREPARING THE COMPOSITE MATERIAL, AND USE THEREOF AKZO NOBEL N.V. (NL) 2009-04-09 WO disclosed
US-20080293849-A1 Nanocomposite Material Comprising Rubber and Modified Layered Double Hydroxide, Process for Its Preparation and Use Thereof VELPERWEG 76 (NL) 2008-11-27 US disclosed
EP-1957575-A1 NANOCOMPOSITE MATERIAL COMPRISING RUBBER AND MODIFIED LAYERED DOUBLE HYDROXIDE, PROCESS FOR ITS PREPARATION AND USE THEREOF Akzo Nobel N.V. (NL) 2008-08-20 EP disclosed
WO-2007065860-A1 NANOCOMPOSITE MATERIAL COMPRISING RUBBER AND MODIFIED LAYERED DOUBLE HYDROXIDE, PROCESS FOR ITS PREPARATION AND USE THEREOF AKZO NOBEL N.V. (NL) 2007-06-14 WO disclosed