SCHEMBL9159679

SCHEMBL9159679

C=CC(=C)CC.C=CC=CC

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.33
ALDH1A1 P00352 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
Butadiene SCHEMBL9361114 0.94 TSHR (0.33) TSHRALDH1A1
SCHEMBL7024222 0.94 TSHR (0.33) TSHRALDH1A1
Butadiene SCHEMBL9361121 0.94 TSHR (0.33) TSHRALDH1A1
SCHEMBL7024225 0.94 TSHR (0.33) TSHRALDH1A1
SCHEMBL8731849 0.90 TSHR (0.39) TSHRALDH1A1
SCHEMBL8731847 0.90 TSHR (0.39) TSHRALDH1A1
Butadiene SCHEMBL9360225 0.87 TSHR (0.33) TSHR
Butadiene SCHEMBL9360221 0.87 TSHR (0.33) TSHR
SCHEMBL93809 0.82
Propane SCHEMBL27390594 0.76

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-0263054-B1 Rubber composition GOODYEAR TIRE & RUBBER (US) 1995-03-15 EP disclosed
US-4843120-A Rubber composition THE GOODYEAR TIRE & RUBBER COMPANY (US) 1989-06-27 US disclosed
EP-0263054-A2 Rubber composition THE GOODYEAR TIRE & RUBBER COMPANY (US) 1988-04-06 EP disclosed