SCHEMBL2921062

SCHEMBL2921062

CC#CC(CC(C)I)OC(N)=O

nearest known ligand 0.35

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.35
CHRM2 P08172 1/20 0.35
CHRM4 P08173 1/20 0.35
CHRM5 P08912 1/20 0.35
CHRM1 P11229 1/20 0.35
CHRM3 P20309 1/20 0.35
CYP2C9 P11712 1/20 0.35
TSHR P16473 1/20 0.35
MAPT P10636 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
SCHEMBL8064369 0.75 LMNA (0.35) LMNACHRM2CHRM4CHRM5CHRM1
SCHEMBL5990419 0.74 LMNA (0.33) LMNACHRM2CHRM4CHRM5CHRM1
SCHEMBL677810 0.68 LMNA (0.32) LMNACHRM2CHRM4CHRM5CHRM1
SCHEMBL29036726 0.68 LMNA (0.32) LMNACHRM2CHRM4CHRM5CHRM1
SCHEMBL868896 0.68 LMNA (0.35) LMNACHRM2CHRM4CHRM5CHRM1
SCHEMBL228837 0.67 LMNA (0.34) LMNACHRM2CHRM4CHRM5CHRM1
SCHEMBL228835 0.64 ALOX15 (0.34) LMNA
SCHEMBL1539596 0.64
SCHEMBL1872666 0.63 LMNA (0.34) LMNACHRM2CHRM4CHRM5CHRM1
SCHEMBL5452343 0.63 CYP2D6 (0.30)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1581052-B1 AN EMOLLIENT ALCOHOL SKIN DISINFECTING FORMULATION BECTON DICKINSON CO (US) 2012-06-13 EP claimed
EP-1581052-B1 AN EMOLLIENT ALCOHOL SKIN DISINFECTING FORMULATION BECTON DICKINSON CO (US) 2012-06-13 EP disclosed
EP-1722859-B1 A BASE COMPOSITION FOR PREPARING MULTI-FUNCTIONAL FORMULATIONS FOR CARE AND PROTECTION OF THE SKIN AND HAIR NATURA COSMETICOS SA (BR) 2010-09-08 EP disclosed
US-20070269389-A1 Base Composition for Preparing Multi-Functional Formulations for Care and Protection of the Skin and Hair NATURA COSMETICOS S.A. (BR) 2007-11-22 US disclosed
EP-1722859-A1 A BASE COMPOSITION FOR PREPARING MULTI-FUNCTIONAL FORMULATIONS FOR CARE AND PROTECTION OF THE SKIN AND HAIR Natura Cosméticos S.A. (BR) 2006-11-22 EP disclosed
WO-2005060923-A1 A BASE COMPOSITION FOR PREPARING MULTI-FUNCTIONAL FORMULATIONS FOR CARE AND PROTECTION OF THE SKIN AND HAIR Natura Cosméticos S.A. (BR) 2005-07-07 WO disclosed