SCHEMBL7105397

SCHEMBL7105397

CCCCC1=Cc2c(-c3ccc(CC)cc3)cccc2C1C[SiH2]CC1C(CCCC)=Cc2c(-c3ccc(CC)cc3)cccc21

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
EDNRB P24530 1/20 0.32
EDNRA P25101 1/20 0.32
TLR8 Q9NR97 1/20 0.31
AGTR1 P30556 1/20 0.31
AGTR2 P50052 1/20 0.31
PSMB5 P28074 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
SCHEMBL7111659 0.95 DRD2 (0.34) EDNRBEDNRATLR8
SCHEMBL7106922 0.94 HSD11B1 (0.34) TLR8PSMB5
SCHEMBL7109568 0.93 TLR8 (0.31) TLR8PSMB5
SCHEMBL7108792 0.93 EDNRB (0.33) EDNRBEDNRA
SCHEMBL7111534 0.91 SLC6A2 (0.37) TLR8
SCHEMBL7108905 0.91 SLC6A2 (0.37) TLR8
SCHEMBL7103915 0.91 HSD11B1 (0.33) TLR8PSMB5
SCHEMBL7109434 0.89 SLC6A2 (0.37) TLR8
SCHEMBL7109747 0.89 ADORA3 (0.30)
SCHEMBL7110770 0.88 HSD11B1 (0.34) TLR8

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-1053263-B1 CATALYST SYSTEM BASELL POLYOLEFINE GMBH (DE) 2003-10-01 EP claimed