SCHEMBL4454333

SCHEMBL4454333

C=C(C)C.CCC(C)OC(C)(C)C

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.31

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
Butanol SCHEMBL4557948 0.94 TSHR (0.42) MAPK1
SCHEMBL12549711 0.87
SCHEMBL110670 0.87
SCHEMBL12013704 0.87
Di(Hydroxyethyl)Ether SCHEMBL4840284 0.76 TSHR (0.42) MAPK1
SCHEMBL7102206 0.73 TSHR (0.31)
SCHEMBL8744994 0.72
SCHEMBL11107351 0.72
SCHEMBL13116647 0.72
SCHEMBL9496877 0.71 TSHR (0.30)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1663916-B1 METHOD FOR CATALYTIC DEOXYGENATION OF PROCESS FLUIDS OF OLEFIN DIMERIZATION PROCESSES NESTE OIL OYJ (FI) 2009-07-01 EP disclosed