Butadiene

Butadiene

SCHEMBL8154680

C=CC.C=CC.C=CC.C=CC.C=CC=C.OCCO

nearest known ligand 0.39

Full drug profile on Sugi Atlas →

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.39

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
Butadiene SCHEMBL18035811 1.00 TSHR (0.39) TSHR
Ethylene Glycol SCHEMBL9133774 0.92 TSHR (0.46) TSHR
Ethylene Glycol SCHEMBL3193155 0.92 TSHR (0.46) TSHR
Ethylene Glycol SCHEMBL7612081 0.92 TSHR (0.46) TSHR
Ethylene Glycol SCHEMBL4769225 0.92 TSHR (0.46) TSHR
Ethylene Glycol SCHEMBL3197361 0.92 TSHR (0.46) TSHR
Ethylene Glycol SCHEMBL5830392 0.92 TSHR (0.46) TSHR
Ethylene Glycol SCHEMBL3171689 0.92 TSHR (0.46) TSHR
Ethylene Glycol SCHEMBL3200076 0.92 TSHR (0.46) TSHR
Ethylene Glycol SCHEMBL9756248 0.92 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0891401-A4 RADIATION-CURABLE COATING COMPOSITIONS AVERY DENNISON CORP (US) 2000-05-24 EP disclosed
EP-0891401-A1 RADIATION-CURABLE COATING COMPOSITIONS AVERY DENNISON CORPORATION (US) 1999-01-20 EP disclosed
WO-1997025389-A1 RADIATION-CURABLE COATING COMPOSITIONS AVERY DENNISON CORPORATION (US) 1997-07-17 WO disclosed