SCHEMBL8412876

SCHEMBL8412876

CC(O)CCC(O)C(C)C.CCC(C)C(O)CC(C)O

nearest known ligand 0.36

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.36

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
SCHEMBL5907214 0.84 TSHR (0.50) TSHR
SCHEMBL2404099 0.79 TSHR (0.39) TSHR
SCHEMBL4883986 0.74 TSHR (0.47) TSHR
SCHEMBL28974912 0.73 TSHR (0.43) TSHR
SCHEMBL4887848 0.71 TSHR (0.41) TSHR
SCHEMBL17929094 0.71 TRPV1 (0.46) TSHR
SCHEMBL4888502 0.71 TSHR (0.41) TSHR
SCHEMBL42177 0.71
SCHEMBL620985 0.71 ALDH1A1 (0.39) TSHR
SCHEMBL5186832 0.71 ALDH1A1 (0.39) 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-0932656-A2 HIGH USAGE OF FABRIC SOFTENER COMPOSITIONS FOR IMPROVED BENEFITS THE PROCTER & GAMBLE COMPANY (US) 1999-08-04 EP disclosed
WO-1998017757-A2 HIGH USAGE OF FABRIC SOFTENER COMPOSITIONS FOR IMPROVED BENEFITS THE PROCTER & GAMBLE COMPANY (US) 1998-04-30 WO disclosed