SCHEMBL7564776

SCHEMBL7564776

CCc1cc(N)c2ncccc2c1CC

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPY1R P25929 8/20 0.48
NSD2 O96028 1/20 0.47
CASP6 P55212 1/20 0.47
G6PD P11413 1/20 0.47
HSP90AA1 P07900 3/20 0.42
HSP90AB1 P08238 2/20 0.42
MEN1 O00255 2/20 0.42
MAPT P10636 2/20 0.42
KMT2A Q03164 2/20 0.42
APAF1 O14727 1/20 0.42
TDP2 O95551 1/20 0.42
ALDH1A1 P00352 1/20 0.42
CASP3 P42574 1/20 0.42
SENP8 Q96LD8 1/20 0.42
SENP7 Q9BQF6 1/20 0.42
SENP6 Q9GZR1 1/20 0.42
IDO1 P14902 1/20 0.40
PSMB5 P28074 1/20 0.40
MMP14 P50281 1/20 0.40
L3MBTL1 Q9Y468 2/20 0.39

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
SCHEMBL2273253 0.80 NSD2 (0.65) NPY1RNSD2CASP6G6PDHSP90AA1
SCHEMBL7566187 0.77 L3MBTL1 (0.58) HSP90AA1MAPTIDO1L3MBTL1NPC1
SCHEMBL7996851 0.77 L3MBTL1 (0.58) HSP90AA1MAPTIDO1L3MBTL1NPC1
SCHEMBL7566133 0.76 ALDH1A1 (0.56) CASP6HSP90AA1HSP90AB1MEN1MAPT
SCHEMBL19009450 0.72 NPC1 (0.47) HSP90AA1MAPTALDH1A1IDO1L3MBTL1
SCHEMBL7567056 0.71 MAPT (0.46) NPY1RHSP90AA1HSP90AB1MEN1MAPT
SCHEMBL2273020 0.70 NSD2 (0.59) NPY1RNSD2CASP6G6PDHSP90AA1
SCHEMBL14347701 0.70 KDM4E (0.52) HSP90AA1MEN1MAPTKMT2AALDH1A1
SCHEMBL29661788 0.70 KDM4E (0.52) HSP90AA1MEN1MAPTKMT2AALDH1A1
SCHEMBL5447339 0.69 HSP90AA1 (0.59) NPY1RNSD2CASP6G6PDHSP90AA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0813608-B1 OSMIUM-CONTAINING REDOX MEDIATOR ROCHE DIAGNOSTICS CORP (US) 2002-09-04 EP disclosed
EP-0813608-A4 OSMIUM-CONTAINING REDOX MEDIATOR ROCHE DIAGNOSTICS CORP (US) 2000-02-09 EP disclosed
US-5846702-A Reagent including an osmium-containing redox mediator BOEHRINGER MANNHEIM CORPORATION (US) 1998-12-08 US disclosed
EP-0813608-A1 OSMIUM-CONTAINING REDOX MEDIATOR BOEHRINGER MANNHEIM CORPORATION (US) 1997-12-29 EP disclosed
US-5589326-A FOR ELECTROCHEMICAL BIOSENSORS BOEHRINGER MANNHEIM CORPORATION (US) 1996-12-31 US disclosed
WO-1996025514-A1 OSMIUM-CONTAINING REDOX MEDIATOR BOEHRINGER MANNHEIM CORPORATION (US) 1996-08-22 WO disclosed