SCHEMBL5336947

SCHEMBL5336947

CCCc1nc2c(N)nc(C)c(C)c2n1CCOCCNC(=O)NC1CCCCC1

nearest known ligand 0.40

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 13/20 0.40
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
EPHX2 P34913 5/20 0.39
GAA P10253 2/20 0.39
TDP1 Q9NUW8 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
SCHEMBL14500921 0.93 EPHX2 (0.40) EPHX1KDM4EALDH1A1EPHX2GAA
SCHEMBL5337899 0.92 EPHX2 (0.44) EPHX1KDM4EALDH1A1EPHX2GAA
SCHEMBL5335421 0.92 EPHX1 (0.38) EPHX1KDM4EALDH1A1EPHX2GAA
SCHEMBL5339657 0.90 EPHX2 (0.39) EPHX1KDM4EALDH1A1EPHX2GAA
SCHEMBL4794207 0.87 TP53 (0.42)
SCHEMBL4882082 0.86 EPHX1 (0.39) EPHX1KDM4EALDH1A1EPHX2GAA
SCHEMBL5341344 0.85 TLR7 (0.37) EPHX1
SCHEMBL4792739 0.84 EPHX1 (0.38) EPHX1KDM4EALDH1A1EPHX2GAA
SCHEMBL5338204 0.84 EPHX1 (0.39) EPHX1KDM4EALDH1A1EPHX2GAA
SCHEMBL5335479 0.84 EPHX1 (0.37) EPHX1KDM4EALDH1A1EPHX2GAA

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
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 EPHX1 386/4885KDM4E 869/4885ALDH1A1 1803/4885
US-20050032830-A1 Immunology for viral diseases and biosynthesis of cytokines of anticancer drugs for tumors IL2, IFNG, TSLP EPHX1 259/4885KDM4E 994/4885ALDH1A1 940/4885
US-20040010007-A1 Ether substituted imidazopyridines IL2, IL4, MYD88 EPHX1 386/4885KDM4E 869/4885ALDH1A1 1803/4885

“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.