SCHEMBL8840388

SCHEMBL8840388

CCOCc1nccc(NC2CCC(C(C)(C)CC)CC2)c1OCC

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
NSD2 O96028 1/20 0.33
GAA P10253 1/20 0.32
PRMT5 O14744 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
SCHEMBL8840391 1.00 NSD2 (0.33) NSD2GAAPRMT5
SCHEMBL8840472 0.91 FGFR2 (0.36) NSD2GAAPRMT5
SCHEMBL8840482 0.91 FGFR2 (0.36) NSD2GAAPRMT5
SCHEMBL8705038 0.84 NSD2 (0.35) NSD2GAAPRMT5
SCHEMBL8705041 0.84 NSD2 (0.35) NSD2GAAPRMT5
SCHEMBL8840569 0.83 FGFR2 (0.33) NSD2GAA
SCHEMBL8840574 0.83 FGFR2 (0.33) NSD2GAA
SCHEMBL8840426 0.80 PRMT5 (0.36) NSD2PRMT5
SCHEMBL8840433 0.80 PRMT5 (0.36) NSD2PRMT5
SCHEMBL8840515 0.79 MAPT (0.35) NSD2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5650417-A Substituted pyridines, their preparation, and their use as pesticides and fungicides HOECHST SCHERING AGREVO GMBH (DE) 1997-07-22 US disclosed
EP-0719255-A1 SUBSTITUTED PYRIDINES, PROCESS FOR PRODUCING THEM AND THEIR USE AS PESTICIDES AND FUNGICIDES Hoechst Schering AgrEvo GmbH (DE) 1996-07-03 EP disclosed
WO-1995007890-A1 SUBSTITUTED PYRIDINES, PROCESS FOR PRODUCING THEM AND THEIR USE AS PESTICIDES AND FUNGICIDES HOECHST SCHERING AGREVO GMBH (DE) 1995-03-23 WO disclosed