SCHEMBL5338910

SCHEMBL5338910

Cc1nc(N)c2nc(C)n(CCOCCNC(=O)N(C)c3ccccc3)c2c1C

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 1/20 0.37
ADRA1A P35348 1/20 0.37
DRD3 P35462 1/20 0.37
TLR7 Q9NYK1 7/20 0.36
TLR8 Q9NR97 3/20 0.34
MAPK1 P28482 1/20 0.32
NTSR1 P30989 1/20 0.32
HTT P42858 1/20 0.32
KMT2A Q03164 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
NOD2 Q9HC29 1/20 0.32
PRMT5 O14744 2/20 0.32
MAPT P10636 1/20 0.31

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
SCHEMBL6279157 0.91 TLR7 (0.37) DRD2ADRA1ADRD3TLR7KMT2A
SCHEMBL6284024 0.89 DRD2 (0.39) DRD2ADRA1ADRD3TLR7PRMT5
SCHEMBL5338885 0.80 SIGMAR1 (0.44) DRD2DRD3
SCHEMBL5338890 0.80 SIGMAR1 (0.44) DRD2DRD3
SCHEMBL6279957 0.80 TLR7 (0.46) TLR7TLR8
SCHEMBL4794572 0.79 MEN1 (0.35) TLR7MAPK1HTTKMT2ASMN1; SMN2
SCHEMBL5347188 0.78 TLR2 (0.40) SMN1; SMN2NPSR1
SCHEMBL7089752 0.76 TLR7 (0.55) TLR7TLR8
SCHEMBL483700 0.76 TLR7 (0.52) TLR7TLR8
SCHEMBL6283619 0.76 TLR7 (0.32) TLR7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7220758-B2 Ether substituted imidazopyridines 3M INNOVATIVE PROPERTIES COMPANY (US) 2007-05-22 US disclosed
US-7220758-B2 Ether substituted imidazopyridines 3M INNOVATIVE PROPERTIES COMPANY (US) 2007-05-22 US disclosed
US-7220758-B2 Ether substituted imidazopyridines 3M INNOVATIVE PROPERTIES COMPANY (US) 2007-05-22 US disclosed
US-20060252792-A1 ETHER SUBSTITUTED IMIDAZOPYRIDINES 3M INNOVATIVE PROPERTIES COMPANY 2006-11-09 US disclosed
US-7125890-B2 Ether substituted imidazopyridines 3M INNOVATIVE PROPERTIES COMPANY (US) 2006-10-24 US disclosed
US-20050032830-A1 Immunology for viral diseases and biosynthesis of cytokines of anticancer drugs for tumors 3M INNOVATIVE PROPERTIES COMPANY 2005-02-10 US disclosed
US-6797718-B2 Ether substituted imidazopyridines 3M INNOVATIVE PROPERTIES COMPANY 2004-09-28 US disclosed
US-20040010007-A1 Ether substituted imidazopyridines 3M INNOVATIVE PROPERTIES COMPANY 2004-01-15 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20060252792-A1 ETHER SUBSTITUTED IMIDAZOPYRIDINES IL2, IL4, MYD88 DRD2 4115/4885ADRA1A 3832/4885DRD3 3889/4885
US-20050032830-A1 Immunology for viral diseases and biosynthesis of cytokines of anticancer drugs for tumors IL2, IFNG, TSLP DRD2 4084/4885ADRA1A 3981/4885DRD3 3802/4885
US-20040010007-A1 Ether substituted imidazopyridines IL2, IL4, MYD88 DRD2 4115/4885ADRA1A 3832/4885DRD3 3889/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.