SCHEMBL4777571

SCHEMBL4777571

Cc1nc(Oc2ccccc2)c(N)c(NCCOCCCc2cccnc2)c1C

nearest known ligand 0.37

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 1/20 0.37
ACP1 P24666 1/20 0.36
PTAFR P25105 3/20 0.35
NMT2 O60551 1/20 0.35
NMT1 P30419 1/20 0.35
CYP2A6 P11509 1/20 0.34
CHRM4 P08173 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
TLR8 Q9NR97 2/20 0.34
TLR7 Q9NYK1 2/20 0.34
GBA1 P04062 1/20 0.34
SERPINE1 P05121 1/20 0.34
HRH1 P35367 2/20 0.33
NOS1 P29475 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C9 P11712 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
SCHEMBL4775513 0.85 LMNA (0.37) CHRNA7ACP1PTAFRNMT2NMT1
SCHEMBL5335896 0.83 ACP1 (0.42) CHRNA7ACP1PTAFRNMT2NMT1
SCHEMBL6698442 0.82 BCHE (0.46)
SCHEMBL4793700 0.81 KMT2A (0.32)
SCHEMBL4775733 0.81 FES (0.35) GBA1NOS1CYP3A4CYP2C9
SCHEMBL4772034 0.78 HTR7 (0.42)
SCHEMBL4777348 0.76 GBA1 (0.36) TDP1L3MBTL1TLR8TLR7GBA1
SCHEMBL28753167 0.73 KMT2A (0.45)
SCHEMBL4794435 0.73 CHRNA7 (0.35) CHRNA7PTAFRTDP1L3MBTL1SERPINE1
SCHEMBL4775915 0.73 ADORA2A (0.41) GBA1

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 CHRNA7 4538/4885ACP1 2322/4885PTAFR 2371/4885
US-20050032830-A1 Immunology for viral diseases and biosynthesis of cytokines of anticancer drugs for tumors IL2, IFNG, TSLP CHRNA7 4849/4885ACP1 2157/4885PTAFR 2122/4885
US-20040010007-A1 Ether substituted imidazopyridines IL2, IL4, MYD88 CHRNA7 4538/4885ACP1 2322/4885PTAFR 2371/4885

“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.