SCHEMBL6974217

SCHEMBL6974217

CC(C)c1nc(CCOC(N)=O)n(Cc2cccc(N)c2)c1Sc1cc(F)cc(F)c1

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TLR7 Q9NYK1 2/20 0.32
F10 P00742 1/20 0.32
GRM2 Q14416 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
SCHEMBL6974575 0.95 TLR7 (0.35) TLR7F10
SCHEMBL6967408 0.91 F10 (0.33) TLR7F10GRM2
SCHEMBL6967887 0.91 LMNA (0.35) TLR7
SCHEMBL6967033 0.91 ENPP2 (0.31) TLR7
SCHEMBL6973223 0.90 TDP1 (0.33) TLR7
SCHEMBL6974966 0.87 GRIN1 (0.36) TLR7GRM2
SCHEMBL6967988 0.87 ENPP2 (0.35)
SCHEMBL6964177 0.87 TLR7 (0.35) TLR7
SCHEMBL6971875 0.86 LMNA (0.41) TLR7
SCHEMBL6960825 0.85 ALDH1A1 (0.32)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0786455-B1 IMIDAZOLE DERIVATIVE SHIONOGI & CO (JP) 2003-12-03 EP disclosed
US-6147097-A METHOD FOR TREATING AIDS SHIONOGI & CO., LTD. (JP) 2000-11-14 US disclosed
US-5910506-A IMIDAZOLE DERIVATIVES, E.G.5-(3,5-DICHLOROPHENYLTHIO)-1,2-DIMETHYL-4-ISOPROPYL-1H-IMIDAZOLE; VIRICIDES; AIDS; NONTOXIC SHIONOGI & CO., LTD. (JP) 1999-06-08 US disclosed
EP-0786455-A1 IMIDAZOLE DERIVATIVE SHIONOGI & CO., LTD. (JP) 1997-07-30 EP disclosed