SCHEMBL4795110

SCHEMBL4795110

CCCc1nc2c(N)nc(C)c(C)c2n1CCOCCN(C)S(=O)(=O)c1cccc2cccnc12

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.40
HPGD P15428 1/20 0.40
TSHR P16473 2/20 0.40
MAPT P10636 3/20 0.37
TP53 P04637 2/20 0.37
POLB P06746 1/20 0.36
HTR7 P34969 3/20 0.36
GAA P10253 1/20 0.35
HTR6 P50406 2/20 0.35
HTT P42858 1/20 0.34
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
MAPK1 P28482 1/20 0.34
CA9 Q16790 1/20 0.34

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
SCHEMBL5336830 0.89 HTR7 (0.39) ALDH1A1HPGDTSHRMAPTTP53
SCHEMBL4795533 0.86 ALDH1A1 (0.40) ALDH1A1HPGDTSHRMAPTTP53
SCHEMBL4793268 0.85 POLB (0.49) ALDH1A1TSHRPOLBHTR7GAA
SCHEMBL4794859 0.81 TLR8 (0.35)
SCHEMBL4791345 0.79 ALDH1A1 (0.40) ALDH1A1HPGDTSHRMAPTTP53
SCHEMBL4792728 0.79 TLR8 (0.33)
SCHEMBL4792832 0.77 HTR7 (0.38) ALDH1A1HPGDMAPTTP53POLB
SCHEMBL4795255 0.75 TLR8 (0.41) HPGD
SCHEMBL5335105 0.75 HTR7 (0.39) ALDH1A1HPGDMAPTTP53POLB
SCHEMBL4794942 0.75 TLR7 (0.38) POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1513524-A4 ETHER SUBSTITUTED IMIDAZOPYRIDINES 3M INNOVATIVE PROPERTIES CO (US) 2008-09-03 EP 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
EP-1513524-A2 ETHER SUBSTITUTED IMIDAZOPYRIDINES 3M Innovative Properties Company (US) 2005-03-16 EP 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
WO-2003103584-A2 ETHER SUBSTITUTED IMIDAZOPYRIDINES 3M INNOVATIVE PROPERTIES COMPANY (US) 2003-12-18 WO 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 (2 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 ALDH1A1 1803/4885HPGD 624/4885TSHR 893/4885
US-20050032830-A1 Immunology for viral diseases and biosynthesis of cytokines of anticancer drugs for tumors IL2, IFNG, TSLP ALDH1A1 940/4885HPGD 326/4885TSHR 938/4885

“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.