SCHEMBL4776209

SCHEMBL4776209

Cc1nc(Cl)c([N+](=O)[O-])c(NCCOCc2ccccc2)c1C

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.41
TP53 P04637 1/20 0.41
PIN1 Q13526 3/20 0.39
MGMT P16455 1/20 0.37
ALDH1A1 P00352 3/20 0.36
GBA1 P04062 1/20 0.36
MAPT P10636 5/20 0.35
HPGD P15428 3/20 0.35
SMN1; SMN2 Q16637 3/20 0.35
GAA P10253 2/20 0.35
DCTPP1 Q9H773 1/20 0.35
HTT P42858 1/20 0.35

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
SCHEMBL4773502 0.91 MGMT (0.38) LMNATP53PIN1MGMTALDH1A1
SCHEMBL4775893 0.84 MAPT (0.48) LMNATP53ALDH1A1MAPTSMN1; SMN2
SCHEMBL4766860 0.84 LMNA (0.41) LMNATP53PIN1MGMTALDH1A1
SCHEMBL2574294 0.83 SMN1; SMN2 (0.47) LMNATP53ALDH1A1MAPTHPGD
SCHEMBL4841863 0.81 NPC1 (0.38) LMNATP53PIN1MGMTALDH1A1
SCHEMBL5340881 0.81 MAPT (0.37) LMNATP53MGMTALDH1A1MAPT
SCHEMBL4773504 0.81 MAPT (0.45) LMNATP53ALDH1A1MAPTSMN1; SMN2
SCHEMBL4794120 0.80 NCF1 (0.40) LMNATP53PIN1MGMTMAPT
SCHEMBL4770133 0.79 SMN1; SMN2 (0.44) LMNATP53ALDH1A1MAPTHPGD
SCHEMBL4775385 0.76 POLB (0.41) LMNAALDH1A1MAPTHPGDSMN1; SMN2

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 10 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
CN-1674894-A Ether substituted imidazopyridines 3M INNOVATIVE PROPERTIES CO (US) 2005-09-28 CN 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 LMNA 4400/4885TP53 226/4885PIN1 611/4885
US-20050032830-A1 Immunology for viral diseases and biosynthesis of cytokines of anticancer drugs for tumors IL2, IFNG, TSLP LMNA 4818/4885TP53 111/4885PIN1 553/4885
US-20040010007-A1 Ether substituted imidazopyridines IL2, IL4, MYD88 LMNA 4400/4885TP53 226/4885PIN1 611/4885

“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.