SCHEMBL6784665

SCHEMBL6784665

CCCCc1nc2c(N)cc3cccnc3c2s1

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 10/20 0.49
TLR7 Q9NYK1 8/20 0.49
IDO1 P14902 1/20 0.37
CASP6 P55212 1/20 0.35
PDPK1 O15530 1/20 0.34
LMNA P02545 1/20 0.34
ADK P55263 1/20 0.34
HSP90AA1 P07900 1/20 0.34
HSP90AB1 P08238 1/20 0.34
CCR1 P32246 1/20 0.33
CCR8 P51685 1/20 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
SCHEMBL1528010 0.80 TLR8 (0.69) TLR8TLR7
SCHEMBL1527960 0.71 TLR8 (0.67) TLR8TLR7
SCHEMBL5765345 0.71 TLR8 (0.48) TLR8TLR7
SCHEMBL3797110 0.67 CASP6 (0.44) IDO1CASP6LMNAHSP90AA1HSP90AB1
SCHEMBL5790821 0.66 TLR8 (0.50) TLR8TLR7
SCHEMBL1528149 0.66 TLR8 (1.00) TLR8TLR7
SCHEMBL21849073 0.65 LMNA (0.43) CASP6LMNAHSP90AA1HSP90AB1CCR1
SCHEMBL31026572 0.65 CCR1 (0.54) TLR8IDO1PDPK1LMNAHSP90AA1
SCHEMBL10688894 0.65 SMN1; SMN2 (0.37) TLR8TLR7LMNACCR1CCR8
SCHEMBL1148845 0.64 HRH1 (0.44)

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-6703402-B2 IMMUNOMODULATORS; INDUCERS OF CYTOKINE BIOSYNTHESIS INCLUDING INTERFERON AND/OR TUMOR NECROSIS FACTOR; ANTITUMOR AGENTS, VIRICIDES 3M INNOVATIVE PROPERTIES COMPANY 2004-03-09 US disclosed