SCHEMBL5594933

SCHEMBL5594933

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

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TSHR P16473 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
SCHEMBL28167341 0.87 TSHR (0.32) TSHR
SCHEMBL29342846 0.85 TSHR (0.36) TSHR
SCHEMBL25654115 0.79 TSHR (0.36) TSHR
SCHEMBL11526148 0.79 TSHR (0.36) TSHR
SCHEMBL5595458 0.79 ACE2 (0.40) TSHR
SCHEMBL4267765 0.76 TSHR (0.48) TSHR
SCHEMBL10836033 0.76 TSHR (0.36) TSHR
SCHEMBL28695276 0.76 LMNA (0.52) TSHR
SCHEMBL12540177 0.74 ALDH1A1 (0.35) TSHR
SCHEMBL3456086 0.74 TSHR (0.46) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1858480-A1 COSMETIC COMPOSITIONS CONTAINING ESTERS BASED ON 2-PROPYLHEPTANOL Cognis IP Management GmbH (DE) 2007-11-28 EP disclosed
WO-2006097235-A1 COSMETIC COMPOSITIONS CONTAINING ESTERS BASED ON 2-PROPYLHEPTANOL COGNIS IP MANAGEMENT GMBH (DE) 2006-09-21 WO disclosed