SCHEMBL6465160

SCHEMBL6465160

[CH]1C(CCCC2=Cc3c(C4CCCCC4)ccc(C4CCCCC4)c3[CH]2)=Cc2c(C3CCCCC3)ccc(C3CCCCC3)c21

nearest known ligand 0.36

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
NUDT1 P36639 1/20 0.36
BACE1 P56817 1/20 0.36
CEL P19835 2/20 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
SCHEMBL6459758 0.98 NUDT1 (0.34) NUDT1BACE1CEL
SCHEMBL6459037 0.95 NUDT1 (0.31) NUDT1BACE1
SCHEMBL6465154 0.68 CEL (0.33) NUDT1BACE1CEL
SCHEMBL2854863 0.66 CEL (0.33) CEL
SCHEMBL6459756 0.66 CEL (0.31) NUDT1BACE1CEL
SCHEMBL10596917 0.62 NUDT1 (0.77) NUDT1BACE1
SCHEMBL6459033 0.62
SCHEMBL27560364 0.61 CEL (0.33) CEL
SCHEMBL27524766 0.61 CEL (0.38) NUDT1BACE1CEL
SCHEMBL27952428 0.60 CEL (0.44) CEL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1049704-B1 BRIDGED METALLOCENES, PREPARATION, USE IN CATALYTIC SYSTEMS BASELL POLYOLEFINE GMBH (DE) 2005-07-27 EP disclosed
US-6433203-B1 COORDINATION POLYMERIZATION CATALYST; ALPHA-OLEFIN POLYMER BASELL TECHNOLOGY COMPANY BV (NL) 2002-08-13 US disclosed