SCHEMBL6923985

SCHEMBL6923985

C=C(OCC(C)C)C(C)(C)CC

nearest known ligand 0.42

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.42
ALDH1A1 P00352 1/20 0.31

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
SCHEMBL12462616 0.80 TSHR (0.37) TSHR
SCHEMBL5333698 0.79 TSHR (0.46) TSHRALDH1A1
SCHEMBL800000 0.77 ALDH1A1 (0.33) TSHRALDH1A1
SCHEMBL2681020 0.74 TSHR (0.42) TSHRALDH1A1
SCHEMBL18367805 0.73
SCHEMBL18591092 0.71 ALDH1A1 (0.33) TSHRALDH1A1
SCHEMBL3149443 0.71 TSHR (0.32) TSHRALDH1A1
SCHEMBL12878806 0.70 TSHR (0.30) TSHR
SCHEMBL12617791 0.70 HTT (0.35)
SCHEMBL18700647 0.70 THRB (0.31)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8309505-B2 Hand dish composition in the form of an article THE PROCTER & GAMBLE COMPANY (US) 2012-11-13 US disclosed
WO-2011084846-A1 QUATERNARY AMMONIUM SALT PRODRUGS ALKERMES, INC. (US) 2011-07-14 WO disclosed
US-20110028373-A1 HAND DISH COMPOSITION IN THE FORM OF AN ARTICLE THE PROCTER & GAMBLE COMPANY 2011-02-03 US disclosed