SCHEMBL6131641

SCHEMBL6131641

CCC(C)COc1ccc2c(c1)C1(c3cc(B(O)OCCO)ccc3-c3cc(OCC(C)CC)c(B(O)O)cc31)c1cc(OCC(C)CC)c(OCC(C)CC)cc1-2

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
GPR88 Q9GZN0 1/20 0.32
PDK2 Q15119 1/20 0.30

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
SCHEMBL2784756 0.90
SCHEMBL4420240 0.80 TLR8 (0.34)
SCHEMBL1155842 0.75 TLR8 (0.36) PDK2
SCHEMBL21985895 0.70 TLR8 (0.35)
SCHEMBL4546505 0.68 TLR8 (0.36) PDK2
SCHEMBL12595641 0.68 TLR8 (0.36) PDK2
SCHEMBL6923222 0.68 TLR8 (0.36)
SCHEMBL13198868 0.68 TLR8 (0.36)
SCHEMBL680229 0.68 TLR8 (0.36)
SCHEMBL6825504 0.67 TLR8 (0.43) GPR88PDK2

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
US-6956095-B2 Process for producing aryl—aryl coupled compounds COVION ORGANIC SEMICONDUCTORS GMBH (DE) 2005-10-18 US disclosed