SCHEMBL8661929

SCHEMBL8661929

C1#Cc2ccccc2C#CCCCC1

nearest known ligand 0.36

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.30

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
SCHEMBL1098772 0.81 TSHR (0.50) TSHR
Fluoride SCHEMBL31607698 0.79 TSHR (0.48) TSHR
SCHEMBL16684913 0.79 TSHR (0.48) TSHR
SCHEMBL9148354 0.78
SCHEMBL9150842 0.75
SCHEMBL29767688 0.73 CYP2A6 (0.36) TSHR
SCHEMBL237481 0.73
SCHEMBL9148625 0.73 CYP2A6 (0.36) TSHR
SCHEMBL31576199 0.73 BCL2L1 (0.31)
SCHEMBL18372858 0.73

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
EP-0874866-A1 FREE RADICAL POLYMERIZATION THE DOW CHEMICAL COMPANY (US) 1998-11-04 EP disclosed
WO-1997026283-A1 FREE RADICAL POLYMERIZATION THE DOW CHEMICAL COMPANY (US) 1997-07-24 WO disclosed
US-5618900-A Free radical polymerization THE DOW CHEMICAL COMPANY (US) 1997-04-08 US disclosed