SCHEMBL4775733

SCHEMBL4775733

Cc1nc(Oc2ccccc2)c(N)c(NCCOCc2ccncc2)c1C

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FES P07332 1/20 0.35
FGFR1 P11362 1/20 0.35
FLT4 P35916 1/20 0.35
KDR P35968 1/20 0.35
GBA1 P04062 1/20 0.35
NOS3 P29474 1/20 0.34
NOS1 P29475 1/20 0.34
NOS2 P35228 1/20 0.34
GHSR Q92847 1/20 0.34
F2 P00734 4/20 0.32
ATP4A P20648 1/20 0.32
ATP4B P51164 1/20 0.32
KCNH2 Q12809 1/20 0.32
GRIN2B Q13224 1/20 0.32
LMNA P02545 1/20 0.32
CYP3A4 P08684 1/20 0.32
HTT P42858 1/20 0.32
MMP13 P45452 1/20 0.32
MAPK14 Q16539 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL4777348 0.87 GBA1 (0.36) GBA1ATP4AATP4BLMNAHTT
SCHEMBL4841863 0.83 NPC1 (0.38) FESFGFR1FLT4KDRGBA1
SCHEMBL4772034 0.82 HTR7 (0.42) ALDH1A1
SCHEMBL4777571 0.81 CHRNA7 (0.37) GBA1NOS1CYP3A4CYP2C9
SCHEMBL4766860 0.76 LMNA (0.41) LMNAHTTSMN1; SMN2ALDH1A1MAPT
SCHEMBL4793700 0.76 KMT2A (0.32)
SCHEMBL1232835 0.76 ALDH1A1 (0.36) LMNAHTTSMN1; SMN2ALDH1A1MAPT
SCHEMBL4775915 0.75 ADORA2A (0.41) GBA1
SCHEMBL4775196 0.74 ALDH1A1 (0.44) ATP4AATP4BLMNACYP3A4HTT
SCHEMBL1232939 0.74 TOP2A (0.37) ALDH1A1

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 9 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
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
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 (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 FES 1473/4885FGFR1 1186/4885FLT4 1448/4885
US-20050032830-A1 Immunology for viral diseases and biosynthesis of cytokines of anticancer drugs for tumors IL2, IFNG, TSLP FES 1361/4885FGFR1 716/4885FLT4 986/4885
US-20040010007-A1 Ether substituted imidazopyridines IL2, IL4, MYD88 FES 1473/4885FGFR1 1186/4885FLT4 1448/4885

“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.