SCHEMBL2126641

SCHEMBL2126641

Cc1cc(NCCNc2ccc(N)c(C)c2)ccc1N

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 5/20 0.53
ALDH1A1 P00352 4/20 0.53
TDP1 Q9NUW8 3/20 0.53
THRB P10828 1/20 0.53
ALOX15 P16050 1/20 0.53
RECQL P46063 1/20 0.53
HIF1A Q16665 1/20 0.53
MAPT P10636 4/20 0.48
TSHR P16473 2/20 0.48
HTT P42858 2/20 0.47
S100B P04271 1/20 0.47
CYP1A2 P05177 1/20 0.47
CYP2D6 P10635 1/20 0.47
CYP2C9 P11712 1/20 0.47
CYP2C19 P33261 1/20 0.47
SKP2 Q13309 1/20 0.41
HRH3 Q9Y5N1 1/20 0.39
GAA P10253 1/20 0.39
ESR1 P03372 2/20 0.38
AR P10275 1/20 0.38

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
SCHEMBL5461611 0.94 CYP3A4 (0.49) CYP3A4ALDH1A1TDP1THRBALOX15
SCHEMBL14672041 0.92 ALDH1A1 (0.47) CYP3A4ALDH1A1TDP1THRBALOX15
SCHEMBL6376391 0.92 ALDH1A1 (0.53) CYP3A4ALDH1A1TDP1THRBALOX15
SCHEMBL2933227 0.92 ALDH1A1 (0.58) CYP3A4ALDH1A1TDP1THRBALOX15
SCHEMBL7139274 0.91 ALDH1A1 (0.49) CYP3A4ALDH1A1TDP1THRBALOX15
Hydrochloric Acid SCHEMBL11700910 0.91 ALDH1A1 (0.46) CYP3A4ALDH1A1TDP1THRBALOX15
SCHEMBL6369975 0.90 ALDH1A1 (0.56) CYP3A4ALDH1A1TDP1THRBALOX15
SCHEMBL6369929 0.90 ALDH1A1 (0.56) CYP3A4ALDH1A1TDP1THRBALOX15
SCHEMBL1436944 0.90 ALDH1A1 (0.49) CYP3A4ALDH1A1TDP1THRBALOX15
Hydrochloric Acid SCHEMBL4952474 0.90 ALDH1A1 (0.51) CYP3A4ALDH1A1TDP1THRBALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220011485-A1 CURABLE COMPOSITION, LIGHT-SHIELDING FILM, COLOR FILTER, PATTERN FORMING METHOD, METHOD FOR MANUFACTURING COLOR FILTER, SOLID-STATE IMAGING ELEMENT, AND INFRARED SENSOR FUJIFILM CORPORATION (JP) 2022-01-13 US disclosed
US-11156754-B2 Curable composition, light-shielding film, color filter, pattern forming method, method for manufacturing color filter, solid-state imaging element, and infrared sensor FUJIFILM CORPORATION (JP) 2021-10-26 US disclosed
EP-3558465-A1 ANHYDROUS SOLID COMPOSITION FOR DYEING KERATIN FIBRES COMPRISING A POLYMER COMPRISING AT LEAST ONE HETEROCYCLIC VINYL MONOMER L'Oreal (FR) 2019-10-30 EP disclosed
US-20190018174-A1 CURABLE COMPOSITION, LIGHT-SHIELDING FILM, COLOR FILTER, PATTERN FORMING METHOD, METHOD FOR MANUFACTURING COLOR FILTER, SOLID-STATE IMAGING ELEMENT, AND INFRARED SENSOR FUJIFILM CORPORATION (JP) 2019-01-17 US disclosed
WO-2018114886-A1 ANHYDROUS SOLID COMPOSITION FOR DYEING KERATIN FIBRES COMPRISING A POLYMER COMPRISING AT LEAST ONE HETEROCYCLIC VINYL MONOMER L'OREAL (FR) 2018-06-28 WO disclosed
EP-2444376-B1 BLACK COMPOSITE PARTICLE, BLACK RESIN COMPOSITION, COLOR FILTER SUBSTRATE AND LIQUID CRYSTAL DISPLAY TORAY INDUSTRIES (JP) 2017-01-25 EP disclosed
WO-2015139883-A1 COMPOSITION FOR ALTERING THE COLOR OF KERATIN FIBERS L'OREAL (FR) 2015-09-24 WO disclosed
EP-2903585-A2 AGENT FOR ALTERING THE COLOR OF KERATIN FIBERS COMPRISING A FATTY SUBSTANCE, A RHEOLOGY MODIFYING POLYMER, AND DIRECT DYES IN AN EMULSION SYSTEM L'OREAL (FR) 2015-08-12 EP disclosed
EP-2903584-A2 AGENT FOR ALTERING THE COLOR OF KERATIN FIBERS CONTAINING A FATTY SUBSTANCE AND A RHEOLOGY MODIFYING POLYMER IN AN EMULSION SYSTEM L'OREAL (FR) 2015-08-12 EP disclosed
WO-2014053504-A2 AGENT FOR ALTERING THE COLOR OF KERATIN FIBERS CONTAINING A FATTY SUBSTANCE AND A RHEOLOGY MODIFYING POLYMER IN AN EMULSION SYSTEM L'OREAL (FR) 2014-04-10 WO disclosed
WO-2010034626-A2 NOVEL DEVELOPER COMPONENTS HENKEL AG & CO. KGAA (DE) 2010-04-01 WO disclosed
US-20100038606-A1 BLACK RESIN COMPOSITION, RESIN BLACK MATRIX, COLOR FILTER AND LIQUID CRYSTAL DISPLAY TORAY INDUSTRIES, INC. (JP) 2010-02-18 US disclosed
EP-2135900-A1 BLACK RESIN COMPOSITION, RESIN BLACK MATRIX, COLOR FILTER AND LIQUID CRYSTAL DISPLAY Toray Industries, Inc. (JP) 2009-12-23 EP disclosed
WO-2007144376-A2 LIGHTENING AND/OR DYEING AGENTS WITH ESTERS AND/OR ANHYDRIDES HENKEL AG & CO. KGAA (DE) 2007-12-21 WO disclosed
EP-1827364-A1 HAIR TREATMENT KIT COMPRISING DYEING AND BLEACHING PRODUCTS HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2007-09-05 EP disclosed
EP-1789013-A1 AGENTS FOR COLOURING FIBRES CONTAINING KERATIN HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2007-05-30 EP disclosed
WO-2006066640-A1 HAIR TREATMENT KIT COMPRISING DYEING AND BLEACHING PRODUCTS HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2006-06-29 WO disclosed
WO-2006024334-A1 AGENTS FOR COLOURING FIBRES CONTAINING KERATIN HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2006-03-09 WO disclosed
EP-1292272-A2 OXIDISED HAIR DYE Henkel Kommanditgesellschaft auf Aktien (DE) 2003-03-19 EP disclosed
WO-2001097766-A2 OXIDISED HAIR DYE HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2001-12-27 WO disclosed