SCHEMBL8064369

SCHEMBL8064369

CC#CC(C)CC(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
SCHEMBL2921062 0.75 LMNA (0.35) LMNACHRM2CHRM4CHRM5CHRM1
SCHEMBL677810 0.71 LMNA (0.32) LMNACHRM2CHRM4CHRM5CHRM1
SCHEMBL29036726 0.68 LMNA (0.32) LMNACHRM2CHRM4CHRM5CHRM1
SCHEMBL868896 0.68 LMNA (0.35) LMNACHRM2CHRM4CHRM5CHRM1
SCHEMBL28165020 0.68
SCHEMBL868897 0.67 CYP2D6 (0.30)
SCHEMBL14773437 0.65
SCHEMBL29009187 0.65
SCHEMBL228835 0.64 ALOX15 (0.34) LMNA
SCHEMBL1539596 0.64

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0684980-B1 IMPROVED AQUEOUS FUNCTIONAL FLUID CINCINNATI MILACRON INC (US) 2000-05-31 EP disclosed
CN-1047614-C Aqueous functional fluid having improved resistance to micro-organisms CINCINNATI MILACRON INC (US) 1999-12-22 CN disclosed
EP-0684980-A4 IMPROVED AQUEOUS FUNCTIONAL FLUID. CINCINNATI MILACRON INC (US) 1996-08-14 EP disclosed
US-5512191-A NITROGEN BEARING COMPOUND, HALOALKYNYLALKYL CARBAMATE CINCINNATI MILACRON INC. (US) 1996-04-30 US disclosed
EP-0684980-A1 IMPROVED AQUEOUS FUNCTIONAL FLUID CINCINNATI MILACRON INC. (US) 1995-12-06 EP disclosed
CN-1111674-A Aqueous functional fluid having improved resistance to micro-organisms CINCINNATI MILACRON INC (US) 1995-11-15 CN disclosed
WO-1995017491-A1 IMPROVED AQUEOUS FUNCTIONAL FLUID CINCINNATI MILACRON INC. (US) 1995-06-29 WO disclosed