SCHEMBL5747274

SCHEMBL5747274

NC(=O)/C=C(\CCCCn1cnc2c(N)nc3ccccc3c21)c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TLR7 Q9NYK1 17/20 0.51
LMNA P02545 1/20 0.50
POLB P06746 1/20 0.50
HRH2 P25021 1/20 0.50
ADRA1D P25100 1/20 0.50
HTR2A P28223 1/20 0.50
ADORA2A P29274 1/20 0.50
ADRA1A P35348 1/20 0.50
NUDT1 P36639 1/20 0.50
HTR2B P41595 1/20 0.50
PDE4D Q08499 1/20 0.50
KCNH2 Q12809 1/20 0.50
HDAC3 O15379 1/20 0.39
HDAC4 P56524 1/20 0.39
HDAC1 Q13547 1/20 0.39
HDAC7 Q8WUI4 1/20 0.39
HDAC2 Q92769 1/20 0.39
HDAC10 Q969S8 1/20 0.39
HDAC11 Q96DB2 1/20 0.39
HDAC8 Q9BY41 1/20 0.39

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
SCHEMBL4148737 0.85 TLR7 (0.55) TLR7LMNAPOLBHRH2ADRA1D
SCHEMBL4143851 0.83 TLR7 (0.57) TLR7LMNAPOLBHRH2ADRA1D
SCHEMBL3862412 0.80 TLR7 (0.53) TLR7LMNAPOLBHRH2ADRA1D
SCHEMBL5749045 0.80 TLR7 (0.55) TLR7LMNAPOLBHRH2ADRA1D
SCHEMBL1335078 0.79 TLR7 (0.62) TLR7LMNAPOLBHRH2ADRA1D
SCHEMBL5748391 0.79 TLR7 (0.53) TLR7LMNAPOLBHRH2ADRA1D
SCHEMBL3863900 0.79 TLR7 (0.53) TLR7LMNAPOLBHRH2ADRA1D
SCHEMBL3866002 0.79 TLR7 (0.53) TLR7LMNAPOLBHRH2ADRA1D
SCHEMBL5749342 0.78 TLR7 (0.54) TLR7LMNAPOLBHRH2ADRA1D
Hydrochloric Acid SCHEMBL1335338 0.78 TLR7 (0.61) TLR7LMNAPOLBHRH2ADRA1D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1187613-B9 AMIDE SUBSTITUTED IMIDAZOQUINOLINES 3M INNOVATIVE PROPERTIES CO (US) 2006-10-25 EP claimed
EP-1187613-B1 AMIDE SUBSTITUTED IMIDAZOQUINOLINES 3M INNOVATIVE PROPERTIES CO (US) 2006-08-09 EP claimed
US-6451810-B1 AID IN CYTOKINE BIOSYNTHESIS 3M INNOVATIVE PROPERTIES COMPANY 2002-09-17 US claimed
EP-1187613-A4 AMIDE SUBSTITUTED IMIDAZOQUINOLINES 3M INNOVATIVE PROPERTIES CO (US) 2002-07-24 EP claimed
EP-1187613-A1 AMIDE SUBSTITUTED IMIDAZOQUINOLINES 3M Innovative Properties Company (US) 2002-03-20 EP claimed
WO-2000076505-A1 AMIDE SUBSTITUTED IMIDAZOQUINOLINES 3M INNOVATIVE PROPERTIES COMPANY (US) 2000-12-21 WO claimed