SCHEMBL4298927

SCHEMBL4298927

O=C1CCCC(=O)O1.OCC(CO)(CO)CO

nearest known ligand 0.46

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.46
CA1 P00915 1/20 0.32
CA9 Q16790 1/20 0.32

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
SCHEMBL6812589 0.90 TSHR (0.58) TSHR
Ethylene SCHEMBL7781608 0.86 TSHR (0.52) TSHR
SCHEMBL11481665 0.80 TSHR (0.46) TSHR
SCHEMBL19926 0.79
SCHEMBL6139293 0.77 TSHR (0.48) TSHR
Methyl Alcohol SCHEMBL28541527 0.76 TSHR (0.59) TSHRCA1CA9
SCHEMBL10784806 0.76 TSHR (0.79) TSHRCA1CA9
Ammonia Solution, Strong SCHEMBL8041261 0.76
SCHEMBL28623233 0.76 TSHR (0.79) TSHRCA1CA9
SCHEMBL157063 0.74 CA1 (0.64) TSHRCA1CA9

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2049167-A1 MOISTURE ACTIVATED LATENT CURING ADHESIVE OR SEALANT Ethicon, Inc (US) 2009-04-22 EP disclosed
EP-2049166-A2 MOISTURE ACTIVATED LATENT CURING ADHESVE OR SEALANT Ethicon, Inc (US) 2009-04-22 EP disclosed
WO-2008021846-A1 MOISTURE ACTIVATED LATENT CURING ADHESIVE OR SEALANT ETHICON, INC. (US) 2008-02-21 WO disclosed
WO-2008019383-A2 MOISTURE ACTIVATED LATENT CURING ADHESVE OR SEALANT ETHICON, INC. (US) 2008-02-14 WO disclosed