SCHEMBL5367478

SCHEMBL5367478

O=[N+]([O-])c1ccc2cccc3c2c1C=C3

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.42
TDP1 Q9NUW8 4/20 0.38
MEN1 O00255 5/20 0.38
KMT2A Q03164 5/20 0.38
KDM4E B2RXH2 3/20 0.38
MAPT P10636 3/20 0.38
GAA P10253 3/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
HTT P42858 1/20 0.38
TYMS P04818 1/20 0.38
PDE10A Q9Y233 1/20 0.38
GPR35 Q9HC97 1/20 0.37
CYP3A4 P08684 2/20 0.37
HSD17B10 Q99714 2/20 0.37
HPRT1 P00492 1/20 0.37
ALOX15 P16050 1/20 0.37
TSHR P16473 4/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
NOS1 P29475 2/20 0.36
NOS2 P35228 2/20 0.36

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
SCHEMBL9484180 0.81 TDP1 (0.52) ALDH1A1TDP1MEN1KMT2APDE10A
SCHEMBL27707616 0.74 ALDH1A1 (0.43) ALDH1A1TDP1MEN1KMT2AKDM4E
SCHEMBL5375649 0.73 TDP1 (0.57) ALDH1A1TDP1MEN1KMT2AKDM4E
SCHEMBL10868265 0.72 MEN1 (0.42) ALDH1A1TDP1MEN1KMT2AKDM4E
Pyrene SCHEMBL27684019 0.71 ALDH1A1 (0.63) ALDH1A1TDP1MEN1KMT2AKDM4E
Trinitrophenol SCHEMBL11881770 0.71 GPR35 (0.51) ALDH1A1TDP1MEN1KMT2AKDM4E
Trinitrophenol SCHEMBL11881772 0.71 GPR35 (0.51) ALDH1A1TDP1MEN1KMT2AKDM4E
SCHEMBL29626558 0.71 ALDH1A1 (0.61) ALDH1A1TDP1MEN1KMT2AKDM4E
SCHEMBL187697 0.71 ALDH1A1 (0.61) ALDH1A1TDP1MEN1KMT2AKDM4E
1-Nitropyrene SCHEMBL339725 0.71 ALDH1A1 (0.57) ALDH1A1TDP1MEN1KMT2AKDM4E

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
CN-113825544-A Cancer cell growth inhibitor and composition for inhibiting cancer cell growth 昭和电工株式会社 2021-12-21 CN disclosed
CN-113811361-A Protective agent against atmospheric pollutants and protective composition against atmospheric pollutants 昭和电工株式会社 2021-12-17 CN disclosed
US-20070248911-A1 Pattern forming method and bilayer film IWASAWA HARUO 2007-10-25 US disclosed
US-7244549-B2 Pattern forming method and bilayer film JSR CORPORATION (JP) 2007-07-17 US disclosed
US-6852791-B2 Anti-reflection coating forming composition JSR CORPORATION (JP) 2005-02-08 US disclosed
EP-1205805-B1 Anti-reflection coating forming composition JSR CORP (JP) 2004-09-15 EP disclosed
US-20030073040-A1 Pattern forming method and bilayer film JSR CORPORATION (JP) 2003-04-17 US disclosed
US-20020086934-A1 Anti-reflection coating forming composition JSR CORPORATION (JP) 2002-07-04 US disclosed
EP-1205805-A1 Anti-reflection coating forming composition JSR Corporation (JP) 2002-05-15 EP disclosed
US-6294593-B1 COMBINING HOST POLYMER WITH GUEST CROSSLINIKING AGENT; EXPOSING COMBINED HOST POLYMER AND GUEST CROSSLINKING AGENT TO ELECTRIC FIELD TO POLE SECOND ORDER NONLINEAR OPTICAL COMPONENT OF POLYMER; EXPOSING TO ELECTROMAGNETIC RADIATION UNIVERSITY OF MASSACHUSETTS LOWELL 2001-09-25 US disclosed
US-5484821-A PHOTOCROSSLINKED UNIVERSITY OF LOWELL (US) 1996-01-16 US disclosed
US-5290824-A Stilbene, azomethine and disazo dyes, polyvinyl cinnamate, polyvinylstyryl acrylate or polyvinyl chalcone polymer matrix UNIVERSITY OF LOWELL (US) 1994-03-01 US disclosed
US-5223356-A Holography UNIVERSITY OF LOWELL (US) 1993-06-29 US disclosed
US-5112881-A Chromogens reacted into crosslinkable polymer, three-dimensional network UNIVERSITY OF LOWELL (US) 1992-05-12 US disclosed