SCHEMBL6779797

SCHEMBL6779797

CCOCc1nc2c(N)nc(C)cc2n1CCCCNC(=O)NC(C)C

nearest known ligand 0.36

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 4/20 0.36
TLR7 Q9NYK1 13/20 0.36
EPHX1 P07099 1/20 0.36
TLR8 Q9NR97 5/20 0.35
MAPT P10636 1/20 0.33
NUDT1 P36639 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
SCHEMBL6773388 0.90 TLR7 (0.37) TLR7TLR8MAPT
SCHEMBL6096657 0.89 LMNA (0.39) BRD4TLR7TLR8NUDT1
SCHEMBL6096076 0.88 TLR7 (0.45) TLR7TLR8NUDT1
SCHEMBL6773525 0.87 TLR7 (0.41) BRD4TLR7TLR8NUDT1
SCHEMBL6778890 0.86 TLR7 (0.40) TLR7TLR8NUDT1
SCHEMBL6782472 0.85 FAAH (0.47) BRD4TLR7EPHX1TLR8MAPT
SCHEMBL6779205 0.84 TLR7 (0.43) TLR7TLR8
SCHEMBL6772056 0.84 KDM4E (0.42) MAPT
SCHEMBL6773884 0.83 TP53 (0.43) MAPT
SCHEMBL6779395 0.83 TLR7 (0.46) TLR7TLR8MAPTNUDT1

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-6720334-B2 IMMUNE RESPONSE MODIFIERS; CYTOKINE BIOSYNTHESIS; VIRAL AND NEOPLASTIC DISEASES; 1-(4-(4-AMINO-6,7-DIMETHYL-1H-IMIDAZO (4,5-C)PYRIDIN-1-YL)BUTYL)-3-PHENYLUREA. 3M INNOVATIVE PROPERTIES COMPANY 2004-04-13 US claimed