SCHEMBL1732586

SCHEMBL1732586

N#Cc1nc(N)c(Cl)nc1C#N

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.45
GAA P10253 2/20 0.45
ALDH1A1 P00352 3/20 0.42
KHK P50053 1/20 0.39
CSNK1A1 P48729 1/20 0.38
CLK4 Q9HAZ1 1/20 0.38
PLAU P00749 2/20 0.32
CYP1A2 P05177 2/20 0.32
GLA P06280 2/20 0.32
HPGD P15428 2/20 0.32
HSD17B10 Q99714 2/20 0.32
THRB P10828 1/20 0.32
CHUK O15111 1/20 0.32
USP8 P40818 3/20 0.31
USP7 Q93009 2/20 0.31
USP47 Q96K76 1/20 0.31
SLC22A1 O15245 1/20 0.31
LMNA P02545 1/20 0.31
HTR1A P08908 1/20 0.31
CYP2D6 P10635 1/20 0.31

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
SCHEMBL3607648 0.88 KDM4E (0.44) KDM4EGAAALDH1A1KHKCSNK1A1
SCHEMBL589590 0.88 ALDH1A1 (0.45) KDM4EGAAALDH1A1KHKCSNK1A1
SCHEMBL23886092 0.82 ALDH1A1 (0.46) KDM4EGAAALDH1A1KHKCSNK1A1
SCHEMBL30177373 0.82 ALDH1A1 (0.46) KDM4EGAAALDH1A1KHKCSNK1A1
SCHEMBL29693655 0.81 KDM4E (0.48) KDM4EGAAALDH1A1KHKCSNK1A1
SCHEMBL29437694 0.81 USP8 (0.35) KDM4EGAAALDH1A1KHKCSNK1A1
SCHEMBL137039 0.81 USP8 (0.35) KDM4EGAAALDH1A1KHKCSNK1A1
SCHEMBL2383543 0.81 KDM4E (0.48) KDM4EGAAALDH1A1KHKCSNK1A1
SCHEMBL29987465 0.80 ALDH1A1 (0.47) KDM4EGAAALDH1A1KHKCSNK1A1
SCHEMBL10087543 0.80 ALDH1A1 (0.47) KDM4EGAAALDH1A1KHKCSNK1A1

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 25 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-4178307-A None JP disclosed
JP-10251259-A None JP disclosed
JP-61204185-A None JP disclosed
US-20180208775-A1 NEW AROMATIC MACROCYCLIC METAL COMPLEX DYES AND THE SYNTHESIS THEREOF WITH ACTIVE NANO METAL POWDERS OLGUN UGURSOY (TR) 2018-07-26 US disclosed
EP-3157927-A1 NEW AROMATIC MACROCYCLIC METAL COMPLEX DYES AND THE SYNTHESIS THEREOF WITH ACTIVE NANO METAL POWDERS Olgun, Ugursoy (TR) 2017-04-26 EP disclosed
WO-2015199628-A1 NEW AROMATIC MACROCYCLIC METAL COMPLEX DYES AND THE SYNTHESIS THEREOF WITH ACTIVE NANO METAL POWDERS OLGUN UĞURSOY (TR) 2015-12-30 WO disclosed
US-8742107-B1 Process for manufacturing bis(2-methoxyethyl)-2,3,6,7-tetracyano-1,4,5,8,9,10-hexazaanthracene Vinazene, Inc. (US) 2014-06-03 US disclosed
US-8742107-B1 Process for manufacturing bis(2-methoxyethyl)-2,3,6,7-tetracyano-1,4,5,8,9,10-hexazaanthracene Vinazene, Inc. (US) 2014-06-03 US disclosed
EP-1467976-B1 N-PYRAZINYL-PHENYLSULPHONAMIDES AND THEIR USE IN THE TREATMENT OF CHEMOKINE MEDIATED DISEASES ASTRAZENECA AB (SE) 2011-11-23 EP disclosed
WO-2011081310-A3 PEPTIDE MARKER FOR CANCER DIAGNOSIS, AND CANCER DIAGNOSIS METHOD USING SAME 한국기초과학지원연구원 (KR) 2011-10-27 WO disclosed
EP-1467976-A1 N-PYRAZINYL-PHENYLSULPHONAMIDES AND THEIR USE IN THE TREATMENT OF CHEMOKINE MEDIATED DISEASES AstraZeneca AB (SE) 2004-10-20 EP disclosed
WO-2003059893-A1 N-PYRAZINYL-PHENYLSULPHONAMIDES AND THEIR USE IN THE TREATMENT OF CHEMOKINE MEDIATED DISEASES ASTRAZENECA AB (SE) 2003-07-24 WO disclosed
JP-H10251259-A 1,4,6,9-TETRAZA-5,10-DEHYDROPHENAZINE DERIVATIVE AND ITS PRODUCTION NIPPON SODA CO LTD 1998-09-22 JP disclosed
US-5583227-A INHIBIT SECRETION OF GASTRIC ACID MOCHIDA PHARMACEUTICAL CO. LTD. (JP) 1996-12-10 US disclosed
EP-0685468-A1 Pyrazine and quinoxaline derivatives and their use as anti-ulcer agents Mochida Pharmaceutical Co., Ltd. (JP) 1995-12-06 EP disclosed
EP-0308895-B1 DICYANOPYRAZINE COMPOUNDS, PROCESS FOR THEIR PREPARATION AND FUNGICIDE HODOGAYA CHEMICAL CO., LTD. (JP) 1993-06-16 EP disclosed
JP-H04178307-A ANTIMICROBIAL AGENT DAINIPPON INK & CHEM INC 1992-06-25 JP disclosed
US-5093335-A Agricultural and horticultural HODOGAYA CHEMICAL COMPANY, LTD. (JP) 1992-03-03 US disclosed
EP-0308895-A1 Dicyanopyrazine compounds, process for their preparation and fungicide HODOGAYA CHEMICAL CO., LTD. (JP) 1989-03-29 EP disclosed
JP-S61204185-A PYRIDOIMIDAZOPYRAZINE DERIVATIVE AND PRODUCTION THEREOF NIPPON SODA CO LTD 1986-09-10 JP disclosed