SCHEMBL4245869

SCHEMBL4245869

CCCn1c(COCC)nc2c[n+]([O-])c3ccc(OC4CCN(C(=O)O)CC4)cc3c21

nearest known ligand 0.34

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
F10 P00742 12/20 0.34
ACSL1 P33121 3/20 0.34
KMT2A Q03164 1/20 0.33
HRH3 Q9Y5N1 1/20 0.33
F2 P00734 5/20 0.33
PRSS1 P07477 2/20 0.33
CHRM2 P08172 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
SCHEMBL4245872 1.00 F10 (0.34) F10ACSL1KMT2AHRH3F2
SCHEMBL4237814 0.90 GPR119 (0.44) KMT2AHRH3
SCHEMBL5803504 0.83 F10 (0.37) F10ACSL1HRH3F2PRSS1
SCHEMBL5618248 0.81 TLR8 (0.46)
SCHEMBL4243570 0.78 TLR7 (0.47)
SCHEMBL1486648 0.78 TLR8 (0.37) KMT2A
SCHEMBL4249965 0.76 SIRT3 (0.40) KMT2A
SCHEMBL4242862 0.75 GPR119 (0.42) KMT2AHRH3
SCHEMBL4246215 0.74 SMN1; SMN2 (0.37) KMT2AHRH3
SCHEMBL4247825 0.73 TLR7 (0.41)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1673087-A4 ALKOXY SUBSTITUTED IMIDAZOQUINOLINES 3M INNOVATIVE PROPERTIES CO (US) 2009-04-08 EP disclosed
EP-1673087-A2 ALKOXY SUBSTITUTED IMIDAZOQUINOLINES 3M Innovative Properties Company (US) 2006-06-28 EP disclosed
WO-2005032484-A2 ALKOXY SUBSTITUTED IMIDAZOQUINOLINES 3M INNOVATIVE PROPERTIES COMPANY (US) 2005-04-14 WO disclosed