SCHEMBL5801688

SCHEMBL5801688

CCCCCCCCCCCCC[N+]1(OC(C)=O)CCOCC1

nearest known ligand 0.40

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CDC25A P30304 1/20 0.40
CES2 O00748 1/20 0.36
LMNA P02545 2/20 0.33
POLB P06746 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
HTT P42858 1/20 0.33
APOBEC3A P31941 1/20 0.33
APOBEC3G Q9HC16 1/20 0.33

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
SCHEMBL16701182 0.85 LMNA (0.41) CES2LMNAAPOBEC3AAPOBEC3G
SCHEMBL15820573 0.83 LMNA (0.39) CES2LMNAAPOBEC3AAPOBEC3G
SCHEMBL16700361 0.78 ALDH1A1 (0.38) CES2LMNAAPOBEC3AAPOBEC3G
Acetic Acid SCHEMBL5801684 0.72 CDC25A (0.54) CDC25ALMNAAPOBEC3AAPOBEC3G
SCHEMBL15209391 0.72 ALDH1A1 (0.33) CES2POLB
SCHEMBL9659452 0.70 CDC25A (0.38) CDC25ACES2LMNAPOLBSMN1; SMN2
SCHEMBL10926866 0.70 CDC25A (0.36) CDC25A
SCHEMBL3275678 0.69 CDC25A (0.41) CDC25A
SCHEMBL4071466 0.69 CDC25A (0.41) CDC25A
SCHEMBL10537448 0.69 CDC25A (0.41) CDC25A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1337613-A4 A CONTROLLED DELIVERY SYSTEM FOR FABRIC CARE PRODUCTS SALVONA LLC (US) 2004-05-12 EP claimed
US-20030166490-A1 Controlled delivery system for fabric care products SALVONA LLC 2003-09-04 US claimed
EP-1337613-A1 A CONTROLLED DELIVERY SYSTEM FOR FABRIC CARE PRODUCTS Salvona L.L.C. (US) 2003-08-27 EP claimed
US-6531444-B1 Fragrant burst upon ironing; hydrophobic candelilla wax/silicon copolymer; cationic charge boosters and fabric softeners SALVONA, LLC 2003-03-11 US claimed
WO-2002038713-A1 A CONTROLLED DELIVERY SYSTEM FOR FABRIC CARE PRODUCTS SALVONA, L.L.C. (US) 2002-05-16 WO claimed
US-7119060-B2 Controlled delivery system for fabric care products SALVONA IP, LLC (US) 2006-10-10 US disclosed
WO-2006078563-A2 A CONTROLLED DELIVERY SYSTEM FOR HOUSEHOLD PRODUCTS NATIONAL STARCH AND CHEMICAL COMPANY (US) 2006-07-27 WO disclosed
US-20050176599-A1 Controlled delivery system for household products BERGQUIST CATHARINE J (US) 2005-08-11 US disclosed
EP-1337613-A4 A CONTROLLED DELIVERY SYSTEM FOR FABRIC CARE PRODUCTS SALVONA LLC (US) 2004-05-12 EP disclosed
US-20030166490-A1 Controlled delivery system for fabric care products SALVONA LLC 2003-09-04 US disclosed
EP-1337613-A1 A CONTROLLED DELIVERY SYSTEM FOR FABRIC CARE PRODUCTS Salvona L.L.C. (US) 2003-08-27 EP disclosed
US-6531444-B1 Fragrant burst upon ironing; hydrophobic candelilla wax/silicon copolymer; cationic charge boosters and fabric softeners SALVONA, LLC 2003-03-11 US disclosed
WO-2002038713-A1 A CONTROLLED DELIVERY SYSTEM FOR FABRIC CARE PRODUCTS SALVONA, L.L.C. (US) 2002-05-16 WO disclosed
US-4096072-A CASTOR OIL, QUATERNARY AMMONIUM SALTS, DETERGENTS THE PROCTER & GAMBLE COMPANY (US) 1978-06-20 US disclosed