SCHEMBL837036

SCHEMBL837036

CCCCCCCCCNC(=N)NC(=N)N(CCN(C(=N)NC(=N)NCCCCCCCCC)c1ccccc1)c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.47
JAK2 O60674 1/20 0.47
RAB9A P51151 1/20 0.47
PAX8 Q06710 1/20 0.47
NAAA Q02083 4/20 0.44
EPHX1 P07099 3/20 0.43
HTT P42858 2/20 0.43
ALDH1A1 P00352 1/20 0.43
GAA P10253 1/20 0.42
MAPT P10636 1/20 0.42
ALOX12 P18054 1/20 0.42
CRHBP P24387 1/20 0.42
CRHR2 Q13324 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
EGFR P00533 1/20 0.40
TP53 P04637 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
HPGD P15428 1/20 0.39
ZDHHC2 Q9UIJ5 1/20 0.38
ASAH1 Q13510 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
Hydrochloric Acid SCHEMBL1683327 0.87 NPC1 (0.49) NPC1JAK2RAB9APAX8NAAA
SCHEMBL29376646 0.84 NAAA (0.44) NPC1JAK2RAB9APAX8NAAA
SCHEMBL4898639 0.83 NPC1 (0.55) NPC1JAK2RAB9APAX8NAAA
SCHEMBL4736491 0.78 NPC1 (0.52) NPC1JAK2RAB9APAX8ALDH1A1
SCHEMBL10728982 0.77 L3MBTL1 (0.49) HTTALDH1A1MAPTTP53SMN1; SMN2
Hydrochloric Acid SCHEMBL2249383 0.76 HPGD (0.43) NPC1RAB9ANAAAEPHX1HTT
SCHEMBL7760882 0.76 NPC1 (0.50) NPC1JAK2RAB9APAX8HTT
Ethylene SCHEMBL25341475 0.76 NPC1 (0.50) NPC1JAK2RAB9APAX8ALDH1A1
SCHEMBL28129333 0.76 TP53 (0.41) NPC1JAK2RAB9APAX8ALDH1A1
SCHEMBL13584685 0.74 EPHX2 (0.54) NAAAEPHX1HTTALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3174446-B1 A METHOD OF MANUAL SURFACE CLEANING USING CLEANING TEXTILES AND OF WASHING SAID CLEANING TEXTILES ECOLAB USA INC (US) 2019-01-30 EP disclosed
US-20170209016-A1 METHOD OF MANUAL SURFACE CLEANING USING CLEANING TEXTILES AND OF WASHING SAID CLEANING TEXTILES ECOLAB USA INC. 2017-07-27 US disclosed
EP-3174446-A1 A METHOD OF MANUAL SURFACE CLEANING USING CLEANING TEXTILES AND OF WASHING SAID CLEANING TEXTILES Ecolab USA Inc. (US) 2017-06-07 EP disclosed
EP-3083916-A1 DISINFECTANT COMPOSITION WITH EXCELLENT FOAM PROFILE AND CLEANING POWER Henkel AG & Co. KGaA (DE) 2016-10-26 EP disclosed
WO-2015091164-A1 DISINFECTANT COMPOSITION WITH EXCELLENT FOAM PROFILE AND CLEANING POWER HENKEL AG & CO. KGAA (DE) 2015-06-25 WO disclosed
WO-2015091163-A1 DISINFECTANT COMPOSITION WITH EXCELLENT FOAM PROFILE HENKEL AG & CO. KGAA (DE) 2015-06-25 WO disclosed
EP-1238054-B2 WASHING AGENT, RINSING AGENT OR CLEANING AGENT PORTIONS WITH ENZYME-CONTROLLED ACTIVE INGREDIENT RELEASE HENKEL AG & CO KGAA (DE) 2012-06-20 EP disclosed
US-8143207-B2 Biocidal textile treatment agent HENKEL AG & CO. KGAA (DE) 2012-03-27 US disclosed
US-7985570-B2 Alkaline proteases and detergents and cleaners comprising these alkaline proteases B.R.A.I.N. BIOTECHNOLOGY RESEARCH AND INFORMATION NETWORK A.G. (DE) 2011-07-26 US disclosed
US-20100298198-A1 Alkaline Proteases and Detergents and Cleaners Comprising These Alkaline Proteases HENKEL KGAA (DE) 2010-11-25 US disclosed
US-20040087475-A1 Quaternary ammonium softener, polyethersiloxane spreading agent and silicone oil ironability enhancer; textile laundering; nonstaining HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (HENKEL KGAA) (DE) 2004-05-06 US disclosed
US-20040031107-A1 Cleaning material HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (HENKEL HGAA) (DE) 2004-02-19 US disclosed
US-6569344-B1 Fabrics; water soluble wetting agent and a salt THE PROCTER & GAMBLE COMPANY 2003-05-27 US disclosed
EP-1238054-A1 WASHING AGENT, RINSING AGENT OR CLEANING AGENT PORTIONS WITH ENZYME-CONTROLLED ACTIVE INGREDIENT RELEASE Henkel Kommanditgesellschaft auf Aktien (DE) 2002-09-11 EP disclosed
EP-1238055-A2 WASHING AGENT, RINSING AGENT OR CLEANING AGENT PORTIONS HAVING REDOX-CONTROLLED ACTIVE SUBSTANCE RELEASE Henkel Kommanditgesellschaft auf Aktien (DE) 2002-09-11 EP disclosed
US-20010031714-A1 Laundry, dishwashing or cleaning product detergent portions with controlled release of active substance HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (HENKEL KGAA) (DE) 2001-10-18 US disclosed
WO-2001044434-A1 WASHING AGENT, RINSING AGENT OR CLEANING AGENT PORTIONS WITH ENZYME-CONTROLLED ACTIVE INGREDIENT RELEASE HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2001-06-21 WO disclosed
WO-2001044433-A1 WASHING AGENT, RINSING AGENT OR CLEANING AGENT PORTIONS WITH CONTROLLED ACTIVE INGREDIENT RELEASE HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2001-06-21 WO disclosed
WO-2001044421-A2 WASHING AGENT, RINSING AGENT OR CLEANING AGENT PORTIONS HAVING REDOX-CONTROLLED ACTIVE SUBSTANCE RELEASE HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2001-06-21 WO disclosed
WO-2001044435-A1 WASHING AGENT, RINSING AGENT OR CLEANING AGENT PORTIONS WITH CONTROLLED ACTIVE INGREDIENT RELEASE HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2001-06-21 WO disclosed