SCHEMBL3223775

SCHEMBL3223775

COc1ccc(Nc2ccc(N(C)C)cc2)cc1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.71
RAB9A P51151 4/20 0.71
GAA P10253 4/20 0.71
NPC1 O15118 3/20 0.71
KDM4E B2RXH2 2/20 0.71
THRB P10828 1/20 0.71
MAPK1 P28482 1/20 0.71
RECQL P46063 1/20 0.71
NPSR1 Q6W5P4 1/20 0.71
TDP1 Q9NUW8 1/20 0.71
L3MBTL1 Q9Y468 1/20 0.71
SMN1; SMN2 Q16637 2/20 0.66
TP53 P04637 1/20 0.66
ESR2 Q92731 1/20 0.66
NOX1 Q9Y5S8 1/20 0.66
SLC2A1 P11166 1/20 0.60
NR4A1 P22736 1/20 0.59
APP P05067 1/20 0.55
KDM1A O60341 3/20 0.52
ALDH1A1 P00352 3/20 0.52

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
SCHEMBL55926 0.87 SLC2A1 (0.75) MAPTRAB9AGAANPC1KDM4E
Hydrochloric Acid SCHEMBL2872287 0.84 SLC2A1 (0.72) MAPTRAB9AGAANPC1KDM4E
SCHEMBL39057 0.84 MAPT (1.00) MAPTRAB9AGAANPC1KDM4E
SCHEMBL1459772 0.84 MAPT (1.00) MAPTRAB9AGAANPC1KDM4E
SCHEMBL222247 0.84 ALDH1A1 (0.65) MAPTRAB9AGAANPC1MAPK1
SCHEMBL9479616 0.84 ALDH1A1 (0.65) MAPTRAB9AGAANPC1MAPK1
SCHEMBL21131515 0.82 MAPT (0.63) MAPTRAB9AGAANPC1KDM4E
SCHEMBL4227376 0.82 MTNR1B (0.59) MAPTRAB9AGAANPC1KDM4E
SCHEMBL16601552 0.82 SCN9A (0.48) MAPTRAB9AGAANPC1KDM4E
SCHEMBL9480806 0.81 RAB9A (0.61) MAPTRAB9AGAANPC1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100061891-A1 Flow analysis system capable of quantitatively or semi-quantitatively determining element in sample CANON SEMICONDUCTOR EQUIPMENT INC. (JP) 2010-03-11 US claimed
US-20100061891-A1 Flow analysis system capable of quantitatively or semi-quantitatively determining element in sample CANON SEMICONDUCTOR EQUIPMENT INC. (JP) 2010-03-11 US disclosed
EP-1354887-B1 Ligands for metals and improved metal-catalyzed processes based thereon MASSACHUSETTS INST TECHNOLOGY (US) 2007-04-25 EP disclosed
EP-1724577-A1 FLOW ANALYSIS SYSTEM CAPABLE OF MEASURING ELEMENT IN SAMPLE QUANTITATIVELY OR SEMI-QUANTITATIVELY FIAMO Corporation (JP) 2006-11-22 EP disclosed
US-20060193747-A1 Flow analysis system capable of measuring element in sample quantitatively or semi quantitatively CANON SEMICONDUCTOR EQUIPMENT INC., (JP) 2006-08-31 US disclosed
EP-1097158-B1 LIGANDS FOR METALS AND METAL-CATALYZED PROCESSES MASSACHUSETTS INST TECHNOLOGY (US) 2006-01-25 EP disclosed
EP-1354887-A1 Ligands for metals and improved metal-catalyzed processes based thereon Massachusetts Insitute of Technology (US) 2003-10-22 EP disclosed
EP-1097158-A2 LIGANDS FOR METALS AND METAL-CATALYZED PROCESSES MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2001-05-09 EP disclosed
WO-2000002887-A2 LIGANDS FOR METALS AND METAL-CATALYZED PROCESSES MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2000-01-20 WO disclosed
US-4051067-A Stabilization of unsaturated carboxylic acid esters with mixtures of polyalkyleneamines and arylenediamines MONSANTO COMPANY (US) 1977-09-27 US disclosed
US-4016198-A Stabilization of unsaturated carboxylic acid esters with mixtures of polyalkylene-amines and arylenediamines MONSANTO COMPANY (US) 1977-04-05 US disclosed