SCHEMBL2831902

SCHEMBL2831902

C=CC(N)n1c(=O)c(Cc2ccccc2)nc2ccccc21

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAOA P21397 8/20 0.51
MAOB P27338 6/20 0.51
MMP9 P14780 5/20 0.51
PTPN1 P18031 1/20 0.46
PDE4A P27815 1/20 0.41
PDE4B Q07343 1/20 0.41
PDE4C Q08493 1/20 0.41
PDE4D Q08499 1/20 0.41
KDM4E B2RXH2 2/20 0.40
ALDH1A1 P00352 2/20 0.40
HPGD P15428 2/20 0.40
HSD17B10 Q99714 2/20 0.40
GAA P10253 1/20 0.40
HTT P42858 1/20 0.40
LMNA P02545 1/20 0.40
MAPK1 P28482 1/20 0.40

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
SCHEMBL1969712 0.80 ALDH1A1 (0.45) PDE4APDE4BPDE4CPDE4DKDM4E
SCHEMBL7513852 0.77 OGFRL1 (0.43) ALDH1A1HTTMAPK1
SCHEMBL28490940 0.73 HDAC6 (0.63) MAOAMAOBMMP9PTPN1PDE4A
SCHEMBL982499 0.72 MAPK1 (0.75) MAOAMAOBMMP9PTPN1PDE4A
SCHEMBL2831908 0.71 MAOA (0.58) MAOAMAOBMMP9PTPN1PDE4A
SCHEMBL10342549 0.70 TSHR (0.52)
SCHEMBL11873127 0.69 HSD17B10 (0.65) KDM4EALDH1A1HPGDHSD17B10GAA
SCHEMBL3903902 0.66 PDE4D (0.46) MAOAMAOBMMP9PDE4APDE4B
SCHEMBL10668761 0.65 KDM4E (0.41) KDM4EALDH1A1HPGDHSD17B10HTT
SCHEMBL979729 0.65 MAPK1 (0.68) MAOAMAOBMMP9PDE4APDE4B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-6239747-A None JP disclosed
JP-6239747-A None JP disclosed
EP-1009316-B1 APPARATUS AND METHOD FOR AN AUDITORY STIMULATOR BAUMAN NATAN (US) 2013-10-09 EP disclosed
US-20100209537-A1 Metal complexes with anticancer activity BANGALORE RAMESH 2010-08-19 US disclosed
EP-1009316-A4 APPARATUS AND METHOD FOR AN AUDITORY STIMULATOR BAUMAN NATAN (US) 2008-11-19 EP disclosed
EP-1009316-A1 APPARATUS AND METHOD FOR AN AUDITORY STIMULATOR Bauman, Natan (US) 2000-06-21 EP disclosed
US-6048305-A Apparatus and method for an open ear auditory pathway stimulator to manage tinnitus and hyperacusis NATAN BAUMAN (US) 2000-04-11 US disclosed
WO-1999007302-A1 APPARATUS AND METHOD FOR AN AUDITORY STIMULATOR BAUMAN NATAN (US) 1999-02-18 WO disclosed
EP-0542689-B1 Use of 1-(aminoalkyl)-3-quinoxaline-2-on derivatives for the preparation of neuroprotective compositions PHAFAG AG (LI) 1998-09-23 EP disclosed
US-5563140-A Use of 1-(aminoalkyl)-3-(benzyl)-quinoxaline-2-one derivatives for the preparation of neuroprotective compositions PHAFAG AKTIENGESELLSCHAFT (LI) 1996-10-08 US disclosed
US-5563140-A Use of 1-(aminoalkyl)-3-(benzyl)-quinoxaline-2-one derivatives for the preparation of neuroprotective compositions PHAFAG AKTIENGESELLSCHAFT (LI) 1996-10-08 US disclosed
JP-H06239747-A METHOD FOR USING 1-(AMINOALKYL)-3-(BENZYL)-QUINOXALINE-2-ONE DERIVATIVE FOR PREPARING NERVEPROTECTIVE COMPOSITION PHAFAG AG 1994-08-30 JP disclosed
JP-H06239747-A METHOD FOR USING 1-(AMINOALKYL)-3-(BENZYL)-QUINOXALINE-2-ONE DERIVATIVE FOR PREPARING NERVEPROTECTIVE COMPOSITION PHAFAG AG 1994-08-30 JP disclosed
EP-0542689-A1 Use of 1-(aminoalkyl)-3-quinoxaline-2-on derivatives for the preparation of neuroprotective compositions PHAFAG AKTIENGESELLSCHAFT (LI) 1993-05-19 EP disclosed