SCHEMBL9190035

SCHEMBL9190035

CCCCOC[CH]COC(C)CC

nearest known ligand 0.42

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.34
CYP3A4 P08684 2/20 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
SCHEMBL615634 0.81 TSHR (0.48) TSHRCYP3A4
SCHEMBL618228 0.77 TSHR (0.50) TSHRCYP3A4
SCHEMBL4834938 0.75 TSHR (0.44) TSHRCYP3A4
SCHEMBL289283 0.75 TSHR (0.44) TSHRCYP3A4
SCHEMBL6178713 0.74 ADRB2 (0.30)
SCHEMBL16079426 0.74
SCHEMBL2759867 0.74
SCHEMBL25970008 0.74
SCHEMBL6168323 0.73 TSHR (0.34) TSHRCYP3A4
SCHEMBL11043138 0.72 THRB (0.50) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0463486-B1 Process for the production of flexographic relief printing plates BASF AG (DE) 1995-10-11 EP disclosed