SCHEMBL8526096

SCHEMBL8526096

CC(C)(C)OC(=O)N1CC1.CCCCCN1CC1

nearest known ligand 0.54

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ TLR8 Q9NR97 1/20 0.54
▸ CNR2 P34972 1/20 0.49
▸ USP2 O75604 1/20 0.47
▸ SMN1; SMN2 Q16637 1/20 0.47
▸ CHRM2 P08172 2/20 0.45
▸ CHRM1 P11229 2/20 0.45
▸ CHRM4 P08173 1/20 0.45
▸ CHRM3 P20309 1/20 0.45
▸ ACKR3 P25106 3/20 0.44
▸ EPHX2 P34913 3/20 0.44
▸ HRH2 P25021 6/20 0.43
▸ HRH1 P35367 6/20 0.43

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
SCHEMBL106768 1.00 TLR8 (0.54) TLR8CNR2USP2SMN1; SMN2CHRM2
SCHEMBL29129466 0.98 TLR8 (0.53) TLR8CNR2USP2SMN1; SMN2CHRM2
SCHEMBL4543892 0.95 TLR8 (0.55) TLR8CNR2USP2SMN1; SMN2CHRM2
SCHEMBL8253901 0.92 USP2 (0.51) TLR8USP2SMN1; SMN2CHRM2CHRM1
Pyrazine SCHEMBL28467340 0.92 TLR8 (0.51) TLR8CNR2CHRM2CHRM1CHRM4
SCHEMBL20873847 0.90 USP2 (0.53) TLR8USP2SMN1; SMN2CHRM2CHRM1
SCHEMBL2616174 0.88 USP2 (0.51) TLR8USP2SMN1; SMN2CHRM2CHRM1
SCHEMBL27097882 0.88 TLR8 (0.50) TLR8EPHX2HRH2HRH1
SCHEMBL12193455 0.87 USP2 (0.47) TLR8USP2SMN1; SMN2CHRM2CHRM1
SCHEMBL8242595 0.86 USP2 (0.61) TLR8USP2SMN1; SMN2CHRM2CHRM1

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-0595924-B1 PLATELET ACTIVATING FACTOR ANTAGONISTS ABBOTT LAB (US) 1999-04-14 — — EP claimed
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