SCHEMBL773669

SCHEMBL773669

C=CC(=O)NCCCC.[NaH]

nearest known ligand 0.81

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ZDHHC20 Q5W0Z9 1/20 0.81
ZDHHC2 Q9UIJ5 1/20 0.81
TSHR P16473 2/20 0.50
ALDH1A1 P00352 1/20 0.50
MAPK1 P28482 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
EPHX1 P07099 5/20 0.48
ACHE P22303 8/20 0.45
MMP2 P08253 1/20 0.45
GAA P10253 1/20 0.44
HTT P42858 2/20 0.41
MAPT P10636 1/20 0.41

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
SCHEMBL117684 0.98
Hydrogen Sulfide SCHEMBL27823449 0.96 ZDHHC20 (0.81) ZDHHC20ZDHHC2TSHRALDH1A1MAPK1
Fluoride SCHEMBL27694682 0.96 ZDHHC20 (0.81) ZDHHC20ZDHHC2TSHRALDH1A1MAPK1
Hydrochloric Acid SCHEMBL15846841 0.96 ZDHHC20 (0.81) ZDHHC20ZDHHC2TSHRALDH1A1MAPK1
Ammonia Solution, Strong SCHEMBL7047534 0.96 ZDHHC20 (0.81) ZDHHC20ZDHHC2TSHRALDH1A1MAPK1
SCHEMBL25367247 0.96 ZDHHC20 (0.81) ZDHHC20ZDHHC2TSHRALDH1A1MAPK1
SCHEMBL14344158 0.96 ZDHHC20 (0.81) ZDHHC20ZDHHC2TSHRALDH1A1MAPK1
Acrylic Acid SCHEMBL20528132 0.94 ZDHHC20 (0.72) ZDHHC20ZDHHC2TSHRALDH1A1MAPK1
Dimethylamine SCHEMBL2500227 0.94 ZDHHC20 (0.78) ZDHHC20ZDHHC2TSHRALDH1A1MAPK1
Sulfuric Acid SCHEMBL10551560 0.92 ZDHHC20 (0.76) ZDHHC20ZDHHC2TSHRALDH1A1MAPK1

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
US-8776880-B2 Process for enhanced oil recovery using the ASP technique S.P.C.M. SA (FR) 2014-07-15 US claimed
US-20120067579-A1 PROCESS FOR ENHANCED OIL RECOVERY USING THE ASP TECHNIQUE S.P.C.M. SA (FR) 2012-03-22 US claimed
US-11285239-B2 Absorbent articles containing a multifunctional gel KIMBERLY-CLARK WORLDWIDE, INC. (US) 2022-03-29 US disclosed
WO-2021115731-A1 MICROPLASTIC-FREE COMPOSITION HENKEL AG & CO. KGAA (DE) 2021-06-17 WO disclosed
WO-2021115730-A1 HAIR STYLING COMPOSITION CONTAINING DISACCHARIDES HENKEL AG & CO. KGAA (DE) 2021-06-17 WO disclosed
EP-3600231-A1 SPRAYABLE COSMETIC AGENT I Henkel AG & Co. KGaA (DE) 2020-02-05 EP disclosed
US-8776880-B2 Process for enhanced oil recovery using the ASP technique S.P.C.M. SA (FR) 2014-07-15 US disclosed
US-20120067579-A1 PROCESS FOR ENHANCED OIL RECOVERY USING THE ASP TECHNIQUE S.P.C.M. SA (FR) 2012-03-22 US disclosed
EP-1109750-B1 PROCESS AND PRODUCT FOR THE INHIBITION OF SCALE IN HARSH SYSTEMS NALCO CO (US) 2004-08-25 EP disclosed
EP-1109750-A4 PROCESS FOR THE INHIBITION OF SCALE IN HARSH SYSTEMS AND NOVEL ANTISCALANTS FOR SAME NALCO CHEMICAL CO (US) 2001-12-05 EP disclosed
EP-1109750-A4 PROCESS FOR THE INHIBITION OF SCALE IN HARSH SYSTEMS AND NOVEL ANTISCALANTS FOR SAME NALCO CHEMICAL CO (US) 2001-12-05 EP disclosed
EP-1109750-A1 PROCESS FOR THE INHIBITION OF SCALE IN HARSH SYSTEMS AND NOVEL ANTISCALANTS FOR SAME NALCO CHEMICAL COMPANY (US) 2001-06-27 EP disclosed
EP-1109750-A1 PROCESS FOR THE INHIBITION OF SCALE IN HARSH SYSTEMS AND NOVEL ANTISCALANTS FOR SAME NALCO CHEMICAL COMPANY (US) 2001-06-27 EP disclosed
WO-2000012436-A1 PROCESS FOR THE INHIBITION OF SCALE IN HARSH SYSTEMS AND NOVEL ANTISCALANTS FOR SAME NALCO CHEMICAL COMPANY (US) 2000-03-09 WO disclosed
WO-2000012436-A1 PROCESS FOR THE INHIBITION OF SCALE IN HARSH SYSTEMS AND NOVEL ANTISCALANTS FOR SAME NALCO CHEMICAL COMPANY (US) 2000-03-09 WO disclosed
EP-0832854-A1 Sulfobetaine-containing polymers and their utility as calcium carbonate scale inhibitors NALCO CHEMICAL COMPANY (US) 1998-04-01 EP disclosed
WO-1995027826-A1 PRE-PASTED WALLCOVERINGS AND THEIR PRODUCTION ALLIED COLLOIDS LIMITED (GB) 1995-10-19 WO disclosed