SCHEMBL623453

SCHEMBL623453

C=CCNCCCC(C)[N+](C)(C)C(C)(CC(=O)O)C(=O)[O-]

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.33
GAA P10253 1/20 0.33
KDM4E B2RXH2 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32

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
SCHEMBL3477943 0.84 ALDH1A1 (0.35) ALDH1A1GAAKDM4EMEN1KMT2A
SCHEMBL609004 0.78 BBOX1 (0.31)
SCHEMBL11132232 0.77 CPB2 (0.33) KDM4E
SCHEMBL7752153 0.77 KDM4C (0.34)
SCHEMBL7752126 0.76 CA2 (0.41)
SCHEMBL97487 0.76 CA2 (0.41)
SCHEMBL7747690 0.76 CA2 (0.41)
SCHEMBL3338797 0.75 TSHR (0.33) NPSR1
SCHEMBL7751708 0.72 FFAR1 (0.42) KMT2ANPSR1
SCHEMBL254215 0.68 ALPL (0.35) ALDH1A1GAAKDM4EMEN1KMT2A

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 17 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3472291-B1 CONCENTRATED ISOTROPIC LIQUID DETERGENTS CONTAINING POLYMERS HENKEL AG & CO KGAA (DE) 2023-12-20 EP disclosed
US-20190024020-A1 CLEANING AGENT CONTAINING PROTEASE AND AMYLASE HENKEL AG & CO. KGAA (DE) 2019-01-24 US disclosed
US-9725686-B2 Strip-form WC cleaning product Henkel AG & Co. KAaA (DE) 2017-08-08 US disclosed
US-9518246-B2 Cleaners for hard surfaces comprising phosphoric acid esters of a polyether-modified alkyl alcohol HENKEL AG & CO. KGAA (DE) 2016-12-13 US disclosed
US-20150376551-A1 CLEANERS FOR HARD SURFACES COMPRISING PHOSPHORIC ACID ESTERS OF A POLYETHER-MODIFIED ALKYL ALCOHOL HENKEL AG & CO. KGAA (DE) 2015-12-31 US disclosed
US-20150020330-A1 STRIP-FORM WC CLEANING PRODUCT HENKEL AG & CO. KGAA (DE) 2015-01-22 US disclosed
US-8202372-B2 Product for treating hard surfaces HENKEL AG & CO. KGAA (DE) 2012-06-19 US disclosed
US-8114223-B2 Glass cleaner comprising an alkylpyrrolidone, glycol ether, and anionic surfactant HENKEL AG & CO. KGAA (DE) 2012-02-14 US disclosed
US-7998919-B2 Compositions for treating hard surfaces comprising silyl polyalkoxylates HENKEL AG & CO. KGAA (DE) 2011-08-16 US disclosed
US-20100062965-A1 Glass Cleaner HENKEL AG & CO. KGAA (DE) 2010-03-11 US disclosed
US-20100056415-A1 COMPOSITIONS FOR TREATING HARD SURFACES Henkel G & Co. KGaA (DE) 2010-03-04 US disclosed
US-20100041574-A1 PRODUCT FOR TREATING HARD SURFACES HENKEL AG & CO. KGAA (DE) 2010-02-18 US disclosed
US-20100022427-A1 PRODUCT FOR TREATING HARD SURFACES HENKEL AG & CO. KGAA (DE) 2010-01-28 US disclosed
US-7098178-B2 Silicic acid ester mixtures HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (HENKEL KGAA) (DE) 2006-08-29 US disclosed
US-20040072704-A1 Silicic acid ester mixtures HENKEL AG & CO. KGAA (DE) 2004-04-15 US disclosed
US-6689223-B1 CLEANING SURFACES USING STORAGE STABLE LIQUID DETERGENTS HAVING INTERFACES WHICH CAN BE EMULSIFIED BY AGITATION HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2004-02-10 US disclosed
US-6440924-B1 HARD SURFACE CLEANERS; CAN BE TEMPORARILY CONVERTED INTO AN EMULSION BY SHAKING; ONE OR MORE HYDROPHOBIC COMPONENTS AND UP TO ABOUT 5% BY WEIGHT OF SODIUM HEXAMETAPHOSPHATE; HIGH PERFORMANCE; STORAGE STABLE HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2002-08-27 US disclosed