SCHEMBL835336

SCHEMBL835336

CCCCN(/C(=N/CC/N=C(\NC(=N)N)N(CCCC)c1ccccc1)NC(=N)N)c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
ALDH1A1 P00352 3/20 0.41
ADRB2 P07550 1/20 0.41
NPC1 O15118 1/20 0.40
JAK2 O60674 1/20 0.40
RAB9A P51151 1/20 0.40
PAX8 Q06710 1/20 0.40
HDAC1 Q13547 1/20 0.39
HDAC6 Q9UBN7 1/20 0.39
TP53 P04637 2/20 0.36
MAPT P10636 1/20 0.36
GRIN2D O15399 1/20 0.35
GRIN3B O60391 1/20 0.35
GRIN1 Q05586 1/20 0.35
GRIN2A Q12879 1/20 0.35
GRIN2B Q13224 1/20 0.35
GRIN2C Q14957 1/20 0.35
GRIN3A Q8TCU5 1/20 0.35
CHRM2 P08172 1/20 0.34

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
SCHEMBL835337 1.00 MEN1 (0.43) MEN1KMT2AALDH1A1ADRB2NPC1
SCHEMBL837035 0.95 NPC1 (0.47) MEN1KMT2AALDH1A1ADRB2NPC1
SCHEMBL837034 0.95 NPC1 (0.47) MEN1KMT2AALDH1A1ADRB2NPC1
SCHEMBL27571661 0.92 MEN1 (0.43) MEN1KMT2AALDH1A1ADRB2NPC1
SCHEMBL27571662 0.90 NPC1 (0.41) MEN1KMT2AALDH1A1ADRB2NPC1
SCHEMBL3191188 0.89 MEN1 (0.39) MEN1KMT2AALDH1A1ADRB2NPC1
SCHEMBL1705232 0.89 MEN1 (0.39) MEN1KMT2AALDH1A1ADRB2NPC1
SCHEMBL1248768 0.88 MEN1 (0.39) MEN1KMT2AALDH1A1ADRB2NPC1
SCHEMBL2163503 0.88 MEN1 (0.39) MEN1KMT2AALDH1A1ADRB2NPC1
SCHEMBL7009170 0.82 NPC1 (0.44) MEN1KMT2AALDH1A1ADRB2NPC1

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 33 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
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-7807616-B2 Geranonitrile substitute HENKEL AG & CO. KGAA (DE) 2010-10-05 US disclosed
US-20050187132-A1 Detergent composition which has been compacted under pressure HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (HENKEL KGAA) (DE) 2005-08-25 US disclosed
US-20050113273-A1 Alkaline protease from bacillus gibsonii (DSM 14393) and washing and cleaning products comprising said alkaline protease HENKEL AG & CO. KGAA (DE) 2005-05-26 US disclosed
US-20050043198-A1 Alkaline protease from Bacillus sp. (DSM 14392) and washing and cleaning products comprising said alkaline protease HENKEL AG & CO. KGAA (DE) 2005-02-24 US disclosed
US-20050009167-A1 Alkaline protease from Bacillus sp. (DSM 14390) and washing and cleaning products comprising said alkaline protease HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (HENKEL KGAA) (DE) 2005-01-13 US disclosed
US-20050003504-A1 Alkaline protease from Bacillus gibsonii (DSM 14391) and washing and cleaning products comprising said alkaline protease HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (HENKEL KGAA) (DE) 2005-01-06 US disclosed
US-20050003985-A1 Alkaline protease variants HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (HENKEL KGAA) (DE) 2005-01-06 US disclosed
US-20050003419-A1 Glycosyl hydrolases B.R.A.I.N. BIOTECHNOLOGY RESEARCH AND INFORMATION NETWORK AG (DE) 2005-01-06 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-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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (6 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20050009167-A1 Alkaline protease from Bacillus sp. (DSM 14390) and washing and cleaning products comprising said alkaline protease ANPEP, TMPRSS15, RNPEP MEN1 2427/4885KMT2A 2700/4885ALDH1A1 3242/4885
US-20050043198-A1 Alkaline protease from Bacillus sp. (DSM 14392) and washing and cleaning products comprising said alkaline protease ANPEP, RNPEP, TMPRSS15 MEN1 2422/4885KMT2A 2103/4885ALDH1A1 3322/4885
US-20050003419-A1 Glycosyl hydrolases AGL, ENGASE, UNG MEN1 2367/4885KMT2A 2364/4885ALDH1A1 1771/4885
US-20050113273-A1 Alkaline protease from bacillus gibsonii (DSM 14393) and washing and cleaning products comprising said alkaline protease PRSS2, ALPI, GBA3 MEN1 2013/4885KMT2A 3199/4885ALDH1A1 3687/4885
US-20050003504-A1 Alkaline protease from Bacillus gibsonii (DSM 14391) and washing and cleaning products comprising said alkaline protease ALPI, RNPEP, PRSS2 MEN1 2184/4885KMT2A 2946/4885ALDH1A1 3657/4885
US-20050003985-A1 Alkaline protease variants LCT, TMPRSS11D, CTRL MEN1 3322/4885KMT2A 920/4885ALDH1A1 2802/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.