SCHEMBL3455995

SCHEMBL3455995

CCCC(C)CC(C)CC(C)CC(C)CC(C)CC(C)CC(C)C

nearest known ligand 0.46

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.46
ALDH1A1 P00352 1/20 0.32
MAPK1 P28482 1/20 0.32

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
SCHEMBL3456086 1.00 TSHR (0.46) TSHRALDH1A1MAPK1
SCHEMBL316818 1.00 TSHR (0.46) TSHRALDH1A1MAPK1
SCHEMBL3456662 1.00 TSHR (0.46) TSHRALDH1A1MAPK1
SCHEMBL3455234 1.00 TSHR (0.46) TSHRALDH1A1MAPK1
SCHEMBL26128817 0.94
SCHEMBL93159 0.94
SCHEMBL31365425 0.91 TSHR (0.53) TSHR
SCHEMBL29197507 0.91 TSHR (0.53) TSHR
SCHEMBL18596803 0.88 TSHR (0.37) TSHRALDH1A1MAPK1
SCHEMBL4269680 0.87 TSHR (0.56) TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150126787-A1 RENEWABLE COMPOSITIONS GEVO, INC. (US) 2015-05-07 US disclosed
US-20140163267-A1 RENEWABLE COMPOSITIONS GEVO, INC. (US) 2014-06-12 US disclosed
US-8546627-B2 Renewable compositions GEVO, INC. (US) 2013-10-01 US disclosed
US-8487149-B2 Renewable compositions GEVO, INC. (US) 2013-07-16 US disclosed
US-8378160-B2 Renewable compositions GEVO, INC. (US) 2013-02-19 US disclosed
US-20120323055-A1 RENEWABLE COMPOSITIONS GEVO, INC. (US) 2012-12-20 US disclosed
US-20120259146-A1 RENEWABLE COMPOSITIONS GEVO DEVELOPMENT, LLC 2012-10-11 US disclosed
US-20120238787-A1 RENEWABLE COMPOSITIONS AGRI-ENERGY, LLC 2012-09-20 US disclosed
US-8193402-B2 Making renewable diesel, biogasoline, or renewable jet fuel; also renewable terephthalate; fermentation to C2-C6 alcohols, dehydration to olefins, oligomerization, and optionally, hydrogenation to alkanes GEVO, INC. (US) 2012-06-05 US disclosed
EP-2225351-A2 RENEWABLE COMPOSITIONS GEVO, Inc. (US) 2010-09-08 EP disclosed
US-20090299109-A1 Renewable Compositions GEVO, INC. 2009-12-03 US disclosed
WO-2009079213-A2 RENEWABLE COMPOSITIONS GEVO, INC. (US) 2009-06-25 WO disclosed