SCHEMBL5523993

SCHEMBL5523993

Nc1ccc(-c2cc(Br)ccc2N)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.50
ALOX15 P16050 1/20 0.50
MAPK1 P28482 1/20 0.50
MAPT P10636 6/20 0.45
MEN1 O00255 5/20 0.45
KMT2A Q03164 5/20 0.45
KDM4E B2RXH2 2/20 0.45
IDO1 P14902 1/20 0.44
GPR35 Q9HC97 1/20 0.44
APP P05067 2/20 0.42
MMP2 P08253 1/20 0.42
MMP9 P14780 1/20 0.42
MMP8 P22894 1/20 0.42
MMP13 P45452 1/20 0.42
TDP1 Q9NUW8 4/20 0.42
CYP3A4 P08684 3/20 0.42
TP53 P04637 1/20 0.42
GLA P06280 1/20 0.39
TSHR P16473 1/20 0.38
S100A4 P26447 1/20 0.37

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
SCHEMBL6036012 0.88 ALDH1A1 (0.52) ALDH1A1ALOX15MAPK1MAPTMEN1
SCHEMBL6572736 0.87 ALDH1A1 (0.50) ALDH1A1ALOX15MAPK1MAPTMEN1
SCHEMBL27670827 0.83 MAPT (0.49) ALDH1A1ALOX15MAPK1MAPTMEN1
SCHEMBL1578380 0.83 SMN1; SMN2 (0.43) ALDH1A1ALOX15MAPK1MAPTMEN1
SCHEMBL5214073 0.83 IDO1 (0.42) ALDH1A1MAPTMEN1KMT2AKDM4E
SCHEMBL98306 0.83 ALDH1A1 (0.54) ALDH1A1MAPK1MAPTMEN1KMT2A
SCHEMBL29492487 0.83 ALDH1A1 (0.54) ALDH1A1MAPK1MAPTMEN1KMT2A
SCHEMBL2479814 0.81 TDP1 (0.50) ALDH1A1ALOX15MAPK1MAPTMEN1
SCHEMBL30075769 0.81 TDP1 (0.50) ALDH1A1ALOX15MAPK1MAPTMEN1
SCHEMBL11518803 0.81 GPR35 (0.53) ALDH1A1ALOX15MAPK1MAPTMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104466253-A LITHIUM-ION SECONDARY BATTERY, AND METHOD OF PRODUCING THE SAME KOJIMA IND CORP 2015-03-25 CN disclosed
US-20150079457-A1 LITHIUM-ION SECONDARY BATTERY, AND METHOD OF PRODUCING THE SAME Kojima Industries Corporation (JP) 2015-03-19 US disclosed
EP-2849255-A1 Lithium-ion secondary battery, and method of producing the same Kojima Industries Corporation (JP) 2015-03-18 EP disclosed
US-20140030607-A1 LITHIUM-ION SECONDARY BATTERY, AND METHOD OF AND APPARATUS FOR PRODUCING THE SAME Kojima Industries Corporation (JP) 2014-01-30 US disclosed
EP-2690686-A1 Lithium-ion secondary battery, method of and apparatus for producing the same Kojima Industries Corporation (JP) 2014-01-29 EP disclosed
US-7279543-B2 Anti-bacterial polymer and method for the preparation thereof, anti-bacterial polymer film and method for the preparation thereof, and article having such a film on the surface thereof ULVAC, INC. (JP) 2007-10-09 US disclosed
US-20040077819-A1 Anti-bacterial polymer and method for the preparation thereof, anti-bacterial polymer film and method for the preparation thereof, and article having such a film on the surface thereof ULVAC, INC. (JP) 2004-04-22 US disclosed
EP-1396514-A1 Anti-bacterial polymer and method for the preparation thereof, anti-bacterial polymer film and method for the preparation thereof, and article having such a film on the surface thereof ULVAC, INC. (JP) 2004-03-10 EP disclosed