SCHEMBL7797191

SCHEMBL7797191

O=[N+]([O-])SC1C=Cc2cccc3cccc1c23

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.35
GAA P10253 2/20 0.35
MAPT P10636 2/20 0.35
KMT2A Q03164 2/20 0.35
KDM4E B2RXH2 1/20 0.35
HTT P42858 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
ALDH1A1 P00352 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
SCHEMBL27427900 0.79 ALDH1A1 (0.32) ALDH1A1
SCHEMBL29145259 0.79 ALDH1A1 (0.32) ALDH1A1
SCHEMBL27494214 0.78
SCHEMBL28114549 0.76 ALDH1A1 (0.30) ALDH1A1
SCHEMBL28999984 0.75
SCHEMBL28670717 0.72 KDM4E (0.30) MAPTKDM4E
SCHEMBL11381619 0.70 MAPT (0.32) MAPT
SCHEMBL345741 0.70 ALDH1A1 (0.35) MEN1MAPTKMT2AKDM4EHTT
SCHEMBL11035480 0.69 ALDH1A1 (0.36) MEN1GAAMAPTKMT2AKDM4E
SCHEMBL4785452 0.69

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-0905123-B1 o-amino(thio)phenol-carboxylic acids and their preparation INFINEON TECHNOLOGIES AG (DE) 2001-12-12 EP disclosed
EP-0918050-B1 Bis-o-amino(thio)phenols and their preparation INFINEON TECHNOLOGIES AG (DE) 2001-12-12 EP disclosed
EP-0918050-A1 Bis-o-amino(thio)phenols and their preparation SIEMENS AKTIENGESELLSCHAFT (DE) 1999-05-26 EP disclosed
EP-0905123-A1 o-amino(thio)phenol-carboxylic acids and their preparation SIEMENS AKTIENGESELLSCHAFT (DE) 1999-03-31 EP disclosed