SCHEMBL4339618

SCHEMBL4339618

O=C(O)c1ccc[n+](-c2ncncn2)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.47
MEN1 O00255 2/20 0.47
HCAR2 Q8TDS4 2/20 0.38
ALDH1A1 P00352 1/20 0.38
APP P05067 1/20 0.38
GAA P10253 1/20 0.38
HCAR3 P49019 1/20 0.38
NAPRT Q6XQN6 2/20 0.38
DAO P14920 1/20 0.38
TSHR P16473 1/20 0.38
GABRP O00591 2/20 0.33
GABRD O14764 2/20 0.33
GABRA1 P14867 2/20 0.33
GABRB1 P18505 2/20 0.33
GABRG2 P18507 2/20 0.33
GABRB3 P28472 2/20 0.33
GABRA5 P31644 2/20 0.33
GABRA3 P34903 2/20 0.33
GABRA2 P47869 2/20 0.33
GABRB2 P47870 2/20 0.33

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
SCHEMBL10477849 0.85 NNMT (0.49) KMT2AMEN1TSHRNNMT
SCHEMBL13880534 0.75 KMT2A (0.46) KMT2AMEN1HCAR2ALDH1A1APP
SCHEMBL126905 0.73 KMT2A (0.55) KMT2AMEN1ALDH1A1NAPRTDAO
Hydrochloric Acid SCHEMBL23630251 0.72 KMT2A (0.53) KMT2AMEN1HCAR2ALDH1A1APP
SCHEMBL17284854 0.68 MEN1 (0.63) KMT2AMEN1HCAR2ALDH1A1APP
Oxiniacic Acid SCHEMBL129209 0.65 MEN1 (1.00) KMT2AMEN1ALDH1A1NAPRTDAO
Oxiniacic Acid SCHEMBL29766756 0.65 MEN1 (1.00) KMT2AMEN1ALDH1A1NAPRTDAO
SCHEMBL9480788 0.65 MEN1 (0.59) KMT2AMEN1HCAR2ALDH1A1APP
Trigonelline SCHEMBL679317 0.65 NNMT (0.68) KMT2AMEN1GAANAPRTDAO
Trigonelline SCHEMBL29581532 0.65 NNMT (0.68) KMT2AMEN1GAANAPRTDAO

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2009030344-A2 DYE CONTAINING POLYGLYCERIN CLARIANT INTERNATIONAL LTD (CH) 2009-03-12 WO claimed
US-7374605-B2 Printing ink applying to various textile materials, the process for preparing it and the printing method using it INKTEC CO.LTD (KR) 2008-05-20 US claimed
EP-1141141-B1 COLORANTS MADE FROM REACTIVE DYES AND FATTY AMINES MILLIKEN & CO (US) 2006-07-05 EP claimed
EP-1141141-A4 COLORANTS MADE FROM REACTIVE DYES AND FATTY AMINES MILLIKEN & CO (US) 2004-09-08 EP claimed
EP-1141141-A1 COLORANTS MADE FROM REACTIVE DYES AND FATTY AMINES Milliken & Company (US) 2001-10-10 EP claimed
US-6287348-B1 FOR COLORING HYDROCARBON AND WAX, SUCH AS CANDLES AND CRAYONS; COLOR STABILITY; STORAGE STABILITY MILLIKEN & COMPANY 2001-09-11 US claimed
WO-2000036024-A1 COLORANTS MADE FROM REACTIVE DYES AND FATTY AMINES MILLIKEN & COMPANY (US) 2000-06-22 WO claimed
EP-0864617-B1 Poly(oxyalkylene)-substituted colorant MILLIKEN RES CORP (US) 1999-12-15 EP claimed
EP-0864617-A1 Poly(oxyalkyline)-substituted colorant MILLIKEN RESEARCH CORPORATION (US) 1998-09-16 EP claimed
US-5766268-A ALSO CONTAINING DYE, ELECTROPHILIC REACTIVE GROUP AND NUCLEOPHILIC LINKING GROUP MILLIKEN RESEARCH CORPORATION (US) 1998-06-16 US claimed
US-5098475-A Inks with dendrimer colorants XEROX CORPORATION (US) 1992-03-24 US claimed
EP-0202656-B1 INK JET PRINTING METHOD CANON KABUSHIKI KAISHA (JP) 1992-01-29 EP claimed
US-4969951-A Cloth jet printing method using aqueous ink having hydroxyl or amino-reactive disperse dye CANON KABUSHIKI KAISHA (JP) 1990-11-13 US claimed
EP-0202656-A2 Ink Jet Printing Method CANON KABUSHIKI KAISHA (JP) 1986-11-26 EP claimed
WO-2023080319-A1 METHOD FOR PREPARING NATURAL INK FOR DIGITAL TEXTILE PRINTING, AND INK 주식회사 디티아이 2023-05-11 WO disclosed
EP-3810701-B1 PRIMER COMPOSITION DDP SPECIALTY ELECTRONIC MATERIALS US LLC (US) 2022-10-19 EP disclosed
US-20210189147-A1 PRIMER COMPOSITION DDP SPECIALTY ELECTRONIC MATERIALS US, LLC 2021-06-24 US disclosed
US-4849770-A FIBER REACTIVE OR DISPERSE DYES IN SOLVENT CANON KABUSHIKI KAISHA (JP) 1989-07-18 US disclosed
US-4722735-A DIFFUSION, FIXING OF IONIC DYE TO FABRIC USING HIGH BOILING ORGANIC LIQUID BURLINGTON INDUSTRIES, INC. (US) 1988-02-02 US disclosed
EP-0202656-A2 Ink Jet Printing Method CANON KABUSHIKI KAISHA (JP) 1986-11-26 EP disclosed